@article{li_deng_whangbo_luo_2022, title={

Orbital projection technique to explore the materials genomes of optical susceptibilities & nbsp;& nbsp;

}, volume={12}, ISSN={["2158-3226"]}, DOI={10.1063/5.0067891}, number={5}, journal={AIP ADVANCES}, author={Li, ZhenHua and Deng, Shuiquan and Whangbo, Myung-Hwan and Luo, Hong-Gang}, year={2022}, month={May} } @article{whangbo_koo_bruecher_puphal_kremer_2022, title={Absence of Spin Frustration in the Kagome Layers of Cu2+ Ions in Volborthite Cu3V2O7(OH)(2)center dot 2H(2)O and Observation of the Suppression and Re-Entrance of Specific Heat Anomalies in Volborthite under an External Magnetic Field}, volume={7}, ISSN={["2410-3896"]}, DOI={10.3390/condmat7010024}, number={1}, journal={CONDENSED MATTER}, author={Whangbo, Myung-Hwan and Koo, Hyun-Joo and Bruecher, Eva and Puphal, Pascal and Kremer, Reinhard K.}, year={2022}, month={Mar} } @article{koo_kremer_whangbo_2022, title={High-Spin Orbital Interactions Across van der Waals Gaps Controlling the Interlayer Ferromagnetism in van der Waals Ferromagnets}, ISSN={["1520-5126"]}, DOI={10.1021/jacs.2c06741}, journal={JOURNAL OF THE AMERICAN CHEMICAL SOCIETY}, author={Koo, Hyun-Joo and Kremer, Reinhard K. and Whangbo, Myung-Hwan}, year={2022}, month={Aug} } @article{moskin_kozlyakova_shvanskaya_chareev_koo_whangbo_vasiliev_2022, title={Highly anisotropic 1/3-magnetization plateau in a ferrimagnet Cs2Cu3(SeO3)(4)center dot 2H(2)O: topology of magnetic bonding necessary for magnetization plateau}, volume={52}, ISSN={["1477-9234"]}, DOI={10.1039/d2dt03517k}, number={1}, journal={DALTON TRANSACTIONS}, author={Moskin, A. V. and Kozlyakova, E. S. and Shvanskaya, L. V. and Chareev, D. A. and Koo, Hyun-Joo and Whangbo, Myung-Hwan and Vasiliev, A. N.}, year={2022}, month={Dec}, pages={118–127} } @article{vasilchikova_vasiliev_evstigneeva_nalbandyan_lee_koo_whangbo_2022, title={Magnetic Properties of A(2)Ni(2)TeO(6) (A = K, Li): Zigzag Order in the Honeycomb Layers of Ni2+ Ions Induced by First and Third Nearest-Neighbor Spin Exchanges}, volume={15}, ISSN={["1996-1944"]}, DOI={10.3390/ma15072563}, number={7}, journal={MATERIALS}, author={Vasilchikova, Tatyana and Vasiliev, Alexander and Evstigneeva, Maria and Nalbandyan, Vladimir and Lee, Ji-Sun and Koo, Hyun-Joo and Whangbo, Myung-Hwan}, year={2022}, month={Apr} } @misc{jiang_deng_whangbo_guo_2022, title={Material research from the viewpoint of functional motifs}, volume={9}, ISSN={["2053-714X"]}, DOI={10.1093/nsr/nwac017}, number={7}, journal={NATIONAL SCIENCE REVIEW}, author={Jiang, Xiao-Ming and Deng, Shuiquan and Whangbo, Myung-Hwan and Guo, Guo-Cong}, year={2022}, month={Aug} } @article{xu_huang_cheng_whangbo_deng_2022, title={Microscopic Mechanism of the Heat-Induced Blueshift in Phosphors and a Logarithmic Energy Dependence on the Nearest Dopant-Vacancy Distance}, ISSN={["1521-3773"]}, DOI={10.1002/anie.202116404}, journal={ANGEWANDTE CHEMIE-INTERNATIONAL EDITION}, author={Xu, Jing and Huang, Xueli and Cheng, Xiyue and Whangbo, Myung-Hwan and Deng, Shuiquan}, year={2022}, month={Feb} } @article{kremer_bette_bruecher_nuss_schulz_whangbo_koo_2022, title={Multiple strongly coupled antiferromagnetic spin S=1/2 dimers in liroconite Cu2Al(As,P)O-4(OH)(4)center dot 4H(2)O}, ISSN={["2196-7105"]}, DOI={10.1515/zkri-2022-0040}, journal={ZEITSCHRIFT FUR KRISTALLOGRAPHIE-CRYSTALLINE MATERIALS}, author={Kremer, Reinhard K. and Bette, Sebastian and Bruecher, Eva and Nuss, Juergen and Schulz, Armin and Whangbo, Myung-Hwan and Koo, Hyun-Joo}, year={2022}, month={Sep} } @article{almoussawi_yao_guo_whangbo_dupray_clevers_deng_kabbour_2022, title={Negative Second Harmonic Response of Sn(4+)in the Fresnoite Oxysulfide Ba2SnSSi2O7}, volume={34}, ISSN={["1520-5002"]}, DOI={10.1021/acs.chemmater.1c04296}, number={10}, journal={CHEMISTRY OF MATERIALS}, author={Almoussawi, Batoul and Yao, Wen-Dong and Guo, Sheng-Ping and Whangbo, Myung-Hwan and Dupray, Valerie and Clevers, Simon and Deng, Shuiquan and Kabbour, Houria}, year={2022}, month={May}, pages={4375–4383} } @article{vasiliev_berdonosov_kozlyakova_maximova_murtazoev_dolgikh_lyssenko_pchelkina_gorbunov_chung_et al._2022, title={Observation of a 1/3 magnetization plateau in Pb2Cu10O4(SeO3)(4)Cl-7 arising from (Cu2+)(7) clusters of corner-sharing (Cu2+)(4) tetrahedra}, ISSN={["1477-9234"]}, DOI={10.1039/d2dt02316d}, journal={DALTON TRANSACTIONS}, author={Vasiliev, A. N. and Berdonosov, P. S. and Kozlyakova, E. S. and Maximova, O. and Murtazoev, A. F. and Dolgikh, V. A. and Lyssenko, K. A. and Pchelkina, Z. and Gorbunov, D. and Chung, S. H. and et al.}, year={2022}, month={Sep} } @article{amano patino_denis romero_koo_avdeev_injac_goto_whangbo_shimakawa_2022, title={Orthogonal antiferromagnetism to canted ferromagnetism in CaCo3Ti4O12 quadruple perovskite driven by underlying kagome lattices}, volume={3}, ISSN={["2662-4443"]}, DOI={10.1038/s43246-022-00274-y}, number={1}, journal={COMMUNICATIONS MATERIALS}, author={Amano Patino, Midori and Denis Romero, Fabio and Koo, Hyun-Joo and Avdeev, Maxim and Injac, Sean D. A. and Goto, Masato and Whangbo, Myung-Hwan and Shimakawa, Yuichi}, year={2022}, month={Aug} } @article{yang_huang_cheng_maggard_whangbo_luan_deng_2022, title={Prediction of Large Second Harmonic Generation in the Metal-Oxide/Organic Hybrid Compound CuMoO3(p2c)}, volume={14}, ISSN={["2073-8994"]}, url={https://www.mdpi.com/2073-8994/14/4/824}, DOI={10.3390/sym14040824}, number={4}, journal={SYMMETRY-BASEL}, author={Yang, Tingting and Huang, Xueli and Cheng, Xiyue and Maggard, Paul A. and Whangbo, Myung-Hwan and Luan, Chengkai and Deng, Shuiquan}, year={2022}, month={Apr} } @article{markina_vasilchikova_kuznetsova_berdonosov_olenev_chung_koo_whangbo_vasiliev_2022, title={Preparation and Characterization of Francisite Solid Solutions Cu3Bi(S(e1-x)TexO(3))(2)O2Br (x=0-1): Possibility for Francisites as Starting Materials for Oxide van der Waals Ferromagnets}, ISSN={["1520-5002"]}, DOI={10.1021/acs.chemmater.2c02865}, journal={CHEMISTRY OF MATERIALS}, author={Markina, Maria and Vasilchikova, Tatyana and Kuznetsova, Elena and Berdonosov, Peter and Olenev, Andrey and Chung, Seung Hwan and Koo, Hyun-Joo and Whangbo, Myung-Hwan and Vasiliev, Alexander}, year={2022}, month={Dec} } @article{lee_park_shim_whangbo_2022, title={Skin-Deep Aspect of Thermopower in Bi(2)Q(3), PbQ, and BiCuQO (Q = Se, Te): Hidden One-Dimensional Character of Their Band Edges Leading to High Thermopower}, ISSN={["1520-4898"]}, DOI={10.1021/acs.accounts.2c00255}, journal={ACCOUNTS OF CHEMICAL RESEARCH}, author={Lee, Changhoon and Park, Taesu and Shim, Ji Hoon and Whangbo, Myung-Hwan}, year={2022}, month={Sep} } @article{whangbo_kremer_koo_2022, title={Unusually High Magnetic Moments Reported for the High-Spin Co2+ Ions at Axially Elongated CoO4X2 (X = Cl, Br, S, Se) Octahedral Sites: Overestimated Magnetic Moments Caused by Underestimated Magnetic Form Factors}, ISSN={["1932-7455"]}, DOI={10.1021/acs.jpcc.2c05586}, journal={JOURNAL OF PHYSICAL CHEMISTRY C}, author={Whangbo, Myung-Hwan and Kremer, Reinhard K. and Koo, Hyun-Joo}, year={2022}, month={Sep} } @article{luo_xu_xia_pang_xu_whangbo_sun_chen_2021, title={Anomaly Negative Resistance Phenomena in Highly Epitaxial PrBa0.7Ca0.3Co2O5+delta Thin Films Induced from Superfast Redox Reactions}, volume={11}, ISSN={["2073-4344"]}, DOI={10.3390/catal11121441}, number={12}, journal={CATALYSTS}, author={Luo, Yumei and Xu, Xing and Xia, Yudong and Pang, Shengli and Xu, Fen and Whangbo, Myung-Hwan and Sun, Lixian and Chen, Chonglin}, year={2021}, month={Dec} } @article{xing_zhou_liu_wang_wang_zheng_dai_whangbo_huang_2021, title={Atomically dispersed cobalt-based species anchored on polythiophene as an efficient electrocatalyst for oxygen evolution reaction}, volume={545}, ISBN={1873-5584}, DOI={10.1016/j.apsusc.2021.148943}, journal={APPLIED SURFACE SCIENCE}, author={Xing, Danning and Zhou, Peng and Liu, Yuanyuan and Wang, Zeyan and Wang, Peng and Zheng, Zhaoke and Dai, Ying and Whangbo, Myung-Hwan and Huang, Baibiao}, year={2021} } @article{zhao_liu_hu_jia_cui_wu_whangbo_ren_2021, title={Difference in magnetic anisotropy of the ferromagnetic monolayers VI3 and CrI3}, volume={103}, ISBN={2469-9969}, DOI={10.1103/PhysRevB.103.014438}, number={1}, journal={PHYSICAL REVIEW B}, author={Zhao, Guo-Dong and Liu, Xingen and Hu, Tao and Jia, Fanhao and Cui, Yaning and Wu, Wei and Whangbo, Myung-Hwan and Ren, Wei}, year={2021} } @article{luo_xu_cheng_li_huang_whangbo_deng_hong_2021, title={High partial thermal conductivity of luminescence sites: a crucial factor for reducing the heat-induced lowering of the luminescence efficiency}, ISSN={["2050-7534"]}, DOI={10.1039/d1tc02287c}, journal={JOURNAL OF MATERIALS CHEMISTRY C}, author={Luo, Ni and Xu, Jing and Cheng, Xiyue and Li, ZhenHua and Huang, Yidong and Whangbo, Myung-Hwan and Deng, Shuiquan and Hong, Maochun}, year={2021}, month={Sep} } @article{etourneau_delmas_jobic_whangbo_2021, title={In Honor of John Bannister Goodenough, an Outstanding Visionary}, volume={26}, ISSN={["1420-3049"]}, DOI={10.3390/molecules26216624}, number={21}, journal={MOLECULES}, author={Etourneau, Jean and Delmas, Claude and Jobic, Stephane and Whangbo, Myung-Hwan}, year={2021}, month={Nov} } @misc{whangbo_koo_kremer_2021, title={Spin Exchanges between Transition Metal Ions Governed by the Ligand p-Orbitals in Their Magnetic Orbitals}, volume={26}, ISBN={1420-3049}, DOI={10.3390/molecules26030531}, number={3}, journal={MOLECULES}, author={Whangbo, Myung-Hwan and Koo, Hyun-Joo and Kremer, Reinhard K.}, year={2021}, month={Feb} } @misc{li_yu_lou_feng_whangbo_xiang_2021, title={Spin Hamiltonians in Magnets: Theories and Computations}, volume={26}, ISBN={1420-3049}, DOI={10.3390/molecules26040803}, number={4}, journal={MOLECULES}, author={Li, Xueyang and Yu, Hongyu and Lou, Feng and Feng, Junsheng and Whangbo, Myung-Hwan and Xiang, Hongjun}, year={2021}, month={Feb} } @article{koo_kremer_whangbo_2021, title={Unusual Spin Exchanges Mediated by the Molecular Anion P2S64-: Theoretical Analyses of the Magnetic Ground States, Magnetic Anisotropy and Spin Exchanges of MPS3 (M = Mn, Fe, Co, Ni)}, volume={26}, ISBN={1420-3049}, DOI={10.3390/molecules26051410}, number={5}, journal={MOLECULES}, author={Koo, Hyun-Joo and Kremer, Reinhard and Whangbo, Myung-Hwan}, year={2021}, month={Mar} } @article{koo_shankar_orlandi_sundaresan_whangbo_2020, title={( )On Ferro- and Antiferro-Spin-Density Waves Describing the Incommensurate Magnetic Structure of NaYNiWO6}, volume={59}, ISBN={1520-510X}, DOI={10.1021/acs.inorgchem.0c02651}, number={24}, journal={INORGANIC CHEMISTRY}, author={Koo, Hyun-Joo and Shankar, Ravi P. N. and Orlandi, Fabio and Sundaresan, Athinarayanan and Whangbo, Myung-Hwan}, year={2020}, pages={17856–17859} } @article{myung-hwan_mao-chun_shui-quan_2020, title={Atom Response Theory of Nonlinear Optical Responses and Its Applications}, volume={39}, ISBN={0254-5861}, DOI={10.14102/j.cnki.0254-5861.2011-3019}, number={12}, journal={CHINESE JOURNAL OF STRUCTURAL CHEMISTRY}, author={Myung-Hwan, Whangbo and Mao-Chun, Hong and Shui-Quan, Deng}, year={2020}, pages={2172–2181} } @article{gao_wu_liang_wang_zheng_wang_liu_dai_whangbo_huang_2020, title={Cu2O Nanoparticles with Both {100} and {111} Facets for Enhancing the Selectivity and Activity of CO2 Electroreduction to Ethylene}, ISBN={2198-3844}, DOI={10.1002/advs.201902820}, journal={ADVANCED SCIENCE}, author={Gao, Yugang and Wu, Qian and Liang, Xizhuang and Wang, Zeyan and Zheng, Zhaoke and Wang, Peng and Liu, Yuanyuan and Dai, Ying and Whangbo, Myung-Hwan and Huang, Baibiao}, year={2020} } @article{wang_wang_zhang_jiang_bao_cheng_zheng_wang_liu_whangbo_et al._2020, title={Enhancing the Photoelectrochemical Water Oxidation Reaction of BiVO4 Photoanode by Employing Carbon Spheres as Electron Reservoirs}, volume={10}, ISBN={2155-5435}, DOI={10.1021/acscatal.0c03671}, number={21}, journal={ACS CATALYSIS}, author={Wang, Minrui and Wang, Zeyan and Zhang, Bo and Jiang, Weiyi and Bao, Xiaolei and Cheng, Hefeng and Zheng, Zhaoke and Wang, Peng and Liu, Yuanyuan and Whangbo, Myung-Hwan and et al.}, year={2020}, pages={13031–13039} } @article{wang_mao_niu_shen_whangbo_huang_dai_2020, title={Ferromagnetic dual topological insulator in a two-dimensional honeycomb lattice}, volume={7}, ISBN={2051-6355}, DOI={10.1039/d0mh00803f}, number={9}, journal={MATERIALS HORIZONS}, author={Wang, Hao and Mao, Ning and Niu, Chengwang and Shen, Shiying and Whangbo, Myung-Hwan and Huang, Baibiao and Dai, Ying}, year={2020}, pages={2431–2438} } @article{zvereva_raganyan_vasilchikova_nalbandyan_gafurov_vavilova_zakharov_koo_pomjakushin_susloparova_et al._2020, title={Hidden magnetic order in the triangular-lattice magnet Li2MnTeO6}, volume={102}, ISBN={2469-9969}, DOI={10.1103/PhysRevB.102.094433}, number={9}, journal={PHYSICAL REVIEW B}, author={Zvereva, E. A. and Raganyan, G. and Vasilchikova, T. M. and Nalbandyan, V. B. and Gafurov, D. A. and Vavilova, E. L. and Zakharov, K. and Koo, H-J and Pomjakushin, V. Yu and Susloparova, A. E. and et al.}, year={2020} } @article{li_ni_li_koo_whangbo_feng_xiang_2020, title={Intralayer ferromagnetism between S=5/2 ions in MnBi2Te4: Role of empty Bi p states}, volume={101}, ISBN={2469-9969}, DOI={10.1103/PhysRevB.101.201408}, number={20}, journal={PHYSICAL REVIEW B}, author={Li, Jing and Ni, J. Y. and Li, X. Y. and Koo, H-J and Whangbo, M-H and Feng, J. S. and Xiang, H. J.}, year={2020} } @article{cheng_li_wu_hong_whangbo_deng_2020, title={Key Factors Controlling the Large Second Harmonic Generation in Nonlinear Optical Materials}, volume={12}, ISBN={1944-8252}, DOI={10.1021/acsami.9b20023}, number={8}, journal={ACS APPLIED MATERIALS & INTERFACES}, author={Cheng, Xiyue and Li, ZhenHua and Wu, Xin-Tao and Hong, Maochun and Whangbo, Myung-Hwan and Deng, Shuiquan}, year={2020}, pages={9434–9439} } @article{yang_hu_wu_whangbo_radaelli_stroppa_2020, title={Magneto-Optical Kerr Switching Properties of (CrI3)(2) and (CrBr3/CrI3) Bilayers}, volume={2}, ISBN={2637-6113}, DOI={10.1021/acsaelm.0c00154}, number={5}, journal={ACS APPLIED ELECTRONIC MATERIALS}, author={Yang, Ke and Hu, Wentao and Wu, Hua and Whangbo, Myung-Hwan and Radaelli, Paolo Giuseppe and Stroppa, Alessandro}, year={2020}, pages={1373–1380} } @article{wang_lv_zhou_liang_wang_liu_wang_zheng_dai_li_et al._2020, title={Molybdenum Nitride Electrocatalysts for Hydrogen Evolution More Efficient than Platinum/Carbon: Mo2N/CeO2@Nickel Foam}, volume={12}, ISBN={1944-8252}, DOI={10.1021/acsami.0c02851}, number={26}, journal={ACS APPLIED MATERIALS & INTERFACES}, author={Wang, Cong and Lv, Xingshuai and Zhou, Peng and Liang, Xizhuang and Wang, Zeyan and Liu, Yuanyuan and Wang, Peng and Zheng, Zhaoke and Dai, Ying and Li, Yingjie and et al.}, year={2020}, pages={29153–29161} } @article{koo_kremer_whangbo_2020, title={Orbital Magnetic Moments of the High-Spin Co2+ Ions at Axially-Elongated Octahedral Sites: Unquenched as Reported from Experiment or Quenched as Predicted by Theory?}, volume={59}, ISBN={1520-510X}, DOI={10.1021/acs.inorgchem.0c02929}, number={24}, journal={INORGANIC CHEMISTRY}, author={Koo, Hyun-Joo and Kremer, Reinhard K. and Whangbo, Myung-Hwan}, year={2020}, pages={18319–18324} } @article{vasilchikova_nalbandyan_shukaev_koo_whangbo_lozitskiy_bogaychuk_kuzmin_tagirov_vavilova_et al._2020, title={Peculiarities of magnetic ordering in the S=5/2 two-dimensional square-lattice antimonate NaMnSbO4}, volume={101}, ISBN={2469-9969}, DOI={10.1103/PhysRevB.101.054435}, number={5}, journal={PHYSICAL REVIEW B}, author={Vasilchikova, Tatyana and Nalbandyan, Vladimir and Shukaev, Igor and Koo, Hyun-Joo and Whangbo, Myung-Hwan and Lozitskiy, Andrey and Bogaychuk, Alexander and Kuzmin, Vyacheslav and Tagirov, Murat and Vavilova, Evgeniya and et al.}, year={2020} } @article{maggard_chen_deng_whangbo_2020, title={Physical Properties of Molecules and Condensed Materials Governed by Onsite Repulsion, Spin-Orbit Coupling and Polarizability of their Constituent Atoms}, volume={25}, ISBN={1420-3049}, url={https://www.mdpi.com/1420-3049/25/4/867}, DOI={10.3390/molecules25040867}, number={4}, journal={Molecules}, author={Maggard, P.A. and Chen, X. and Deng, S. and Whangbo, M}, year={2020}, pages={867} } @article{jia_cheng_whangbo_hong_deng_2020, title={Second harmonic generation responses of KH2PO4: importance of K and breaking down of Kleinman symmetry}, volume={10}, ISBN={2046-2069}, DOI={10.1039/d0ra03136d}, number={44}, journal={RSC ADVANCES}, author={Jia, Minghao and Cheng, Xiyue and Whangbo, Myung-Hwan and Hong, Maochun and Deng, Shuiquan}, year={2020}, pages={26479–26485} } @article{sorolla_wang_koo_whangbo_jacobson_2020, title={Synthesis of the Elusive S=1/2 Star Structure: A Possible Quantum Spin Liquid Candidate}, volume={142}, ISBN={1520-5126}, DOI={10.1021/jacs.0c00901}, number={11}, journal={JOURNAL OF THE AMERICAN CHEMICAL SOCIETY}, author={Sorolla, Maurice, II and Wang, Xiqu and Koo, Hyun-Joo and Whangbo, Myung-Hwan and Jacobson, Allan J.}, year={2020}, pages={5013–5016} } @article{lee_kim_son_shim_whangbo_2020, title={Ternary selenides A(2)Sb(4)Se(8) (A = K, Rb and Cs) as an n-type thermoelectric material with high power factor and low lattice thermal conductivity: importance of the conformationally flexible Sb-Se-Se-Sb bridges}, volume={10}, ISBN={2046-2069}, DOI={10.1039/d0ra01751e}, number={24}, journal={RSC ADVANCES}, author={Lee, Changhoon and Kim, Sujee and Son, Won-Joon and Shim, Ji-Hoon and Whangbo, Myung-Hwan}, year={2020}, pages={14415–14421} } @article{cai_cheng_whangbo_hong_deng_2020, title={The partition principles for atomic-scale structures and their physical properties: application to the nonlinear optical crystal material KBe2BO3F2}, volume={22}, ISBN={1463-9084}, DOI={10.1039/d0cp02755c}, number={34}, journal={PHYSICAL CHEMISTRY CHEMICAL PHYSICS}, author={Cai, Zewen and Cheng, Xiyue and Whangbo, Myung-Hwan and Hong, Maochun and Deng, Shuiquan}, year={2020}, pages={19299–19306} } @article{golubev_nuss_kremer_gordon_whangbo_ritter_weber_wessel_2020, title={Two-dimensional magnetism in alpha-CuV2O6}, volume={102}, ISBN={2469-9969}, DOI={10.1103/PhysRevB.102.014436}, number={1}, journal={PHYSICAL REVIEW B}, author={Golubev, A. M. and Nuss, J. and Kremer, R. K. and Gordon, E. E. and Whangbo, M-H and Ritter, C. and Weber, L. and Wessel, S.}, year={2020} } @article{cheng_whangbo_hong_deng_2019, title={Dependence of the Second-Harmonic Generation Response on the Cell Volume to Band-Gap Ratio}, volume={58}, ISBN={1520-510X}, DOI={10.1021/acs.inorgchem.9b01368}, number={15}, journal={INORGANIC CHEMISTRY}, author={Cheng, Xiyue and Whangbo, Myung-Hwan and Hong, Maochun and Deng, Shuiquan}, year={2019}, pages={9572–9575} } @article{koo_whangbo_2019, title={Effect of Nonmagnetic Ion Deficiency on Magnetic Structure: Density Functional Study of Sr2MnO2Cu2-xTe2, Sr2MO2Cu2Te2 (M = Co, Mn), and the Oxide-Hydrides Sr2VO3H, Sr3V2O5H2, and SrVO2H}, volume={58}, ISBN={1520-510X}, DOI={10.1021/acs.inorgchem.9b02456}, number={21}, journal={INORGANIC CHEMISTRY}, author={Koo, Hyun-Joo and Whangbo, Myung-Hwan}, year={2019}, pages={14769–14776} } @article{li_jin_wang_liu_wang_zheng_whangbo_kou_li_dai_et al._2019, title={Effect of the intra- and inter-triazine N-vacancies on the photocatalytic hydrogen evolution of graphitic carbon nitride}, volume={369}, ISBN={1873-3212}, DOI={10.1016/j.cej.2019.03.095}, journal={CHEMICAL ENGINEERING JOURNAL}, author={Li, Huiliang and Jin, Cui and Wang, Zeyan and Liu, Yuanyuan and Wang, Peng and Zheng, Zhaoke and Whangbo, Myung-Hwan and Kou, Liangzhi and Li, Yingjie and Dai, Ying and et al.}, year={2019}, pages={263–271} } @article{whangbo_xiang_koo_gordon_whitten_2019, title={Electronic and Structural Factors Controlling the Spin Orientations of Magnetic Ions}, volume={58}, ISBN={1520-510X}, ISSN={0020-1669 1520-510X}, url={http://dx.doi.org/10.1021/acs.inorgchem.9b00687}, DOI={10.1021/acs.inorgchem.9b00687}, number={18}, journal={Inorganic Chemistry}, publisher={American Chemical Society (ACS)}, author={Whangbo, Myung-Hwan and Xiang, Hongjun and Koo, Hyun-Joo and Gordon, Elijah E. and Whitten, Jerry L.}, year={2019}, month={Jun}, pages={11854–11874} } @article{gao_li_zhou_wang_zheng_wang_liu_dai_whangbo_huang_2019, title={Enhanced selectivity and activity for electrocatalytic reduction of CO2 to CO on an anodized Zn/carbon/Ag electrode}, volume={7}, ISBN={2050-7496}, DOI={10.1039/c9ta04529e}, number={28}, journal={JOURNAL OF MATERIALS CHEMISTRY A}, author={Gao, Yugang and Li, Fengping and Zhou, Peng and Wang, Zeyan and Zheng, Zhaoke and Wang, Peng and Liu, Yuanyuan and Dai, Ying and Whangbo, Myung-Hwan and Huang, Baibiao}, year={2019}, pages={16685–16689} } @article{an_liu_bian_wang_wang_zheng_dai_whangbo_huang_2019, title={Improving the photocatalytic hydrogen evolution of UiO-67 by incorporating Ce4+-coordinated bipyridinedicarboxylate ligands}, volume={64}, ISBN={2095-9281}, DOI={10.1016/j.scib.2019.07.030}, number={20}, journal={SCIENCE BULLETIN}, author={An, Yang and Liu, Yuanyuan and Bian, Hongtao and Wang, Zeyan and Wang, Peng and Zheng, Zhaoke and Dai, Ying and Whangbo, Myung-Hwan and Huang, Baibiao}, year={2019}, pages={1502–1509} } @article{guan_wu_wang_zhang_wang_zheng_liu_dai_whangbo_huang_2019, title={Perovskite photocatalyst CsPbBr3-xIx with a bandgap funnel structure for H-2 evolution under visible light}, volume={245}, ISBN={1873-3883}, DOI={10.1016/j.apcatb.2019.01.019}, journal={APPLIED CATALYSIS B-ENVIRONMENTAL}, author={Guan, Zihan and Wu, Yaqiang and Wang, Peng and Zhang, Qianqian and Wang, Zeyan and Zheng, Zhaoke and Liu, Yuanyuan and Dai, Ying and Whangbo, Myung-Hwan and Huang, Baibiao}, year={2019}, pages={522–527} } @article{zhang_liu_wang_wang_zheng_qin_zhang_dai_whangbo_huang_2019, title={Selective photocatalytic conversion of alcohol to aldehydes by singlet oxygen over Bi-based metal-organic frameworks under UV-vis light irradiation}, volume={254}, ISBN={1873-3883}, DOI={10.1016/j.apcatb.2019.05.024}, journal={APPLIED CATALYSIS B-ENVIRONMENTAL}, author={Zhang, Ruoqian and Liu, Yuanyuan and Wang, Zeyan and Wang, Peng and Zheng, Zhaoke and Qin, Xiaoyan and Zhang, Xiaoyang and Dai, Ying and Whangbo, Myung-Hwan and Huang, Baibiao}, year={2019}, pages={463–470} } @article{an_liu_wang_wang_zheng_dai_qin_zhang_whangbo_huang_2019, title={Stabilizing the titanium-based metal organic frameworks in water by metal cations with empty or partially-filled d orbitals}, volume={533}, DOI={10.1016/j.jcis.2018.08.049}, journal={JOURNAL OF COLLOID AND INTERFACE SCIENCE}, author={An, Yang and Liu, Yuanyuan and Wang, Zeyan and Wang, Peng and Zheng, Zhaoke and Dai, Ying and Qin, Xiaoyan and Zhang, Xiaoyang and Whangbo, Myung-Hwan and Huang, Baibiao}, year={2019}, pages={9–12} } @article{uma_vasilchikova_sobolev_raganyan_sethi_koo_whangbo_presniakov_glazkova_vasiliev_et al._2019, title={Synthesis and Characterization of Sodium-Iron Antimonate Na2FeSbO5: One-Dimensional Antiferromagnetic Chain Compound with a Spin-Glass Ground State}, volume={58}, ISBN={1520-510X}, DOI={10.1021/acs.inorgchem.9b00212}, number={17}, journal={INORGANIC CHEMISTRY}, author={Uma, Sitharaman and Vasilchikova, Tatyana 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DOI={10.1021/jacs.9b04627}, number={24}, journal={JOURNAL OF THE AMERICAN CHEMICAL SOCIETY}, author={Chi, Yang and Xu, Jing and Xue, Huai-Guo and Zhang, Yueping and Chen, Xiaolong and Whangbo, Myung-Hwan and Guo, Sheng-Ping and Deng, Shuiquan}, year={2019}, pages={9533–9536} } @article{liang_wang_li_zhang_wang_dai_zhang_liu_whangbo_huang_2018, title={Adsorption of gaseous ethylene via induced polarization on plasmonic photocatalyst Ag/AgCl/TiO2 and subsequent photodegradation}, volume={220}, DOI={10.1016/j.apcatb.2017.07.075}, journal={Applied Catalysis. B, Environmental}, author={Liang, X. Z. and Wang, P. and Li, M. M. and Zhang, Q. Q. and Wang, Z. Y. and Dai, Y. and Zhang, X. Y. and Liu, Y. Y. and Whangbo, M. H. and Huang, B. B.}, year={2018}, pages={356–361} } @article{zhu_wang_wang_liu_zheng_zhang_zhang_dai_whangbo_huang_2018, title={Co3O4 nanobelt arrays assembled with ultrathin nanosheets as highly efficient and stable electrocatalysts for the chlorine evolution reaction}, volume={6}, DOI={10.1039/c8ta03689f}, number={26}, journal={Journal of Materials Chemistry A}, author={Zhu, X. L. and Wang, P. and Wang, Z. Y. and Liu, Y. Y. and Zheng, Z. K. and Zhang, Q. Q. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H. and Huang, B. B.}, year={2018}, pages={12718–12723} } @article{lee_kim_tak_cho_shim_lim_whangbo_2018, title={Comparison of the electronic and thermoelectric properties of three layered phases Bi2Te3, PbBi2Te4 and PbBi4Te7: LEGO thermoelectrics}, volume={8}, DOI={10.1063/1.5047823}, number={11}, journal={AIP ADVANCES}, author={Lee, Changhoon and Kim, Jae Nyeong and Tak, Jang-Yeul and Cho, Hyung Koun and Shim, Ji Hoon and Lim, Young Soo and Whangbo, Myung-Hwan}, year={2018} } @article{wu_wang_zhu_zhang_wang_liu_zou_dai_whangbo_huang_2018, title={Composite of CH3NH3PbI3 with reduced graphene oxide as a highly efficient and stable visible-light photocatalyst for hydrogen evolution in aqueous HI solution}, volume={30}, number={7}, journal={Advanced Materials}, author={Wu, Y. Q. and Wang, P. and Zhu, X. L. and Zhang, Q. Q. and Wang, Z. Y. and Liu, Y. Y. and Zou, G. Z. and Dai, Y. and Whangbo, M. H. and Huang, B. B.}, year={2018} } @article{lou_zhu_yang_zhang_whangbo_li_huang_2018, title={Continual injection of photoinduced electrons stabilizing surface plasmon resonance of non-elemental-metal plasmonic photocatalyst CdS/WO3-x for efficient hydrogen generation}, volume={226}, DOI={10.1016/j.apcatb.2017.12.023}, journal={Applied Catalysis. B, Environmental}, author={Lou, Z. Z. and Zhu, M. S. and Yang, X. G. and Zhang, Y. and Whangbo, M. H. and Li, B. J. and Huang, B. B.}, year={2018}, pages={10–15} } @article{li_zhang_wang_wang_liu_zhang_qin_dai_whangbo_huang_2018, title={Endotaxial growth of [100]-oriented TaON films on LiTaO3 single crystals for enhanced photoelectrochemical water splitting}, volume={2}, number={6}, journal={Solar RRL}, author={Li, H. L. and Zhang, B. and Wang, Z. Y. and Wang, P. and Liu, Y. Y. and Zhang, X. Y. and Qin, X. Y. and Dai, Y. and Whangbo, M. H. and Huang, B. B.}, year={2018} } @article{wu_wang_guan_liu_wang_zheng_jin_dai_whangbo_huang_2018, title={Enhancing the Photocatalytic Hydrogen Evolution Activity of Mixed-Halide Perovskite CH3NH3PbBr3-xIx Achieved by Bandgap Funneling of Charge Carriers}, volume={8}, DOI={10.1021/acscatal.8b02374}, number={11}, journal={ACS CATALYSIS}, author={Wu, Yaqiang and Wang, Peng and Guan, Zihan and Liu, Junxue and Wang, Zeyan and Zheng, Zhaoke and Jin, Shengye and Dai, Ying and Whangbo, Myung-Hwan and Huang, Baibiao}, year={2018}, pages={10349–10357} } @article{lomnytska_dzevenko_babizhetskyy_toma_smolyak_gordon_whangbo_kohler_2018, title={Interaction of tantalum, titanium and phosphorus at 1070 K: Phase diagram and structural chemistry}, volume={732}, DOI={10.1016/j.jallcom.2017.10.247}, journal={Journal of Alloys and Compounds}, author={Lomnytska, Y. and Dzevenko, M. and Babizhetskyy, V. and Toma, O. and Smolyak, O. and Gordon, E. E. and Whangbo, M. H. and Kohler, J.}, year={2018}, pages={777–783} } @article{whangbo_deng_koehler_simon_2018, title={Interband Electron Pairing for Superconductivity from the Breakdown of the Born-Oppenheimer Approximation}, volume={19}, DOI={10.1002/cphc.201800738}, number={23}, journal={CHEMPHYSCHEM}, author={Whangbo, Myung-Hwan and Deng, Shuiquan and Koehler, Juergen and Simon, Arndt}, year={2018}, pages={3191–3195} } @article{golubev_bruecher_schulz_kremer_schmidt_gordon_whangbo_2018, title={Low-Dimensional Magnetic Properties of Natural and Synthetic Mixite (Bi,Ca)Cu-6(OH)(6)(AsO4)(3)center dot nH(2)O (n approximate to 3) and Goudeyite YCu6(OH)(6)(AsO4)(3)center dot nH(2)O (n approximate to 3)}, volume={644}, DOI={10.1002/zaac.201800344}, number={24}, journal={ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE}, author={Golubev, Aleksandr and Bruecher, Eva and Schulz, Armin and Kremer, Reinhard K. and Schmidt, Franz X. and Gordon, Elija E. and Whangbo, Myung-Hwan}, year={2018}, pages={1782–1790} } @article{leiner_oh_kolesnikov_stone_le_kenny_powell_mourigal_gordon_whangbo_et al._2018, title={Magnetic excitations of the Cu2+ quantum spin chain in Sr3CuPtO6}, volume={97}, DOI={10.1103/physrevb.97.104426}, number={10}, journal={Physical Review B}, author={Leiner, J. C. and Oh, J. and Kolesnikov, A. I. and Stone, M. B. and Le, M. D. and Kenny, E. P. and Powell, B. J. and Mourigal, M. and Gordon, E. E. and Whangbo, M. H. and et al.}, year={2018} } @article{gordon_cheng_kim_cheong_deng_whangbo_2018, title={Nonequivalent Spin Exchanges of the Hexagonal Spin Lattice Affecting the Low-Temperature Magnetic Properties of RInO3 (R = Gd, Tb, Dy): Importance of Spin-Orbit Coupling for Spin Exchanges between Rare-Earth Cations with Nonzero Orbital Moments}, volume={57}, DOI={10.1021/acs.inorgchem.8b01274}, number={15}, journal={INORGANIC CHEMISTRY}, author={Gordon, Elijah E. and Cheng, Xiyue and Kim, Jaewook and Cheong, Sang-Wook and Deng, Shuiquan and Whangbo, Myung-Hwan}, year={2018}, pages={9260–9265} } @article{gordon_derakhshan_thompson_whangho_2018, title={Spin-Density Wave as a Superposition of Two Magnetic States of Opposite Chirality and Its Implications}, volume={57}, DOI={10.1021/acs.inorgchem.8b01494}, number={16}, journal={INORGANIC CHEMISTRY}, author={Gordon, Elijah E. and Derakhshan, Shahab and Thompson, Corey M. and Whangho, Myung-Hwan}, year={2018}, pages={9782–9785} } @article{cheng_whangbo_guo_hong_deng_2018, title={The large second-harmonic generation of LiCs2PO4 is caused by the metal-cation-centered groups}, volume={57}, DOI={10.1002/anie.201711465}, number={15}, journal={Angewandte Chemie [International Edition in English]}, author={Cheng, X. Y. and Whangbo, M. H. and Guo, G. C. and Hong, M. C. and Deng, S. Q.}, year={2018}, pages={3933–3937} } @article{lu_mentre_gordon_whangbo_wattiaux_duttine_tiercelin_kabbour_2017, title={A comprehensive study of magnetic exchanges in the layered oxychalcogenides Sr(3)Fe(2)O(5)Cu(2)Q(2) (Q = S, Se)}, volume={444}, DOI={10.1016/j.jmmm.2017.07.026}, journal={Journal of Magnetism and Magnetic Materials}, author={Lu, M. F. and Mentre, O. and Gordon, E. E. and Whangbo, M. H. and Wattiaux, A. and Duttine, M. and Tiercelin, N. and Kabbour, H.}, year={2017}, pages={147–153} } @article{xu_an_liu_qin_zhang_dai_wang_wang_whangbo_huang_2017, title={Enhancing the photocatalytic activity of BiOX (X = Cl, Br, and I), (BiO)(2)CO3 and Bi2O3 by modifying their surfaces with polar organic anions, 4-substituted thiophenolates}, volume={5}, DOI={10.1039/c7ta03970k}, number={27}, journal={Journal of Materials Chemistry A}, author={Xu, B. Y. and An, Y. and Liu, Y. Y. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Wang, Z. Y. and Wang, P. and Whangbo, M. H. and Huang, B. B.}, year={2017}, pages={14406–14414} } @article{barroux_jiang_paul_massuyeau_geois_gordon_whangbo_jobic_gautier_2017, title={Fine-tuning the properties of doped multifunctional materials by controlled reduction of dopants}, volume={23}, DOI={10.1002/chem.201605707}, number={13}, journal={Chemistry (Weinheim An Der Bergstrasse, Germany)}, author={Barroux, H. and Jiang, T. and Paul, C. and Massuyeau, F. and Geois, R. and Gordon, E. E. and Whangbo, M. H. and Jobic, S. and Gautier, R.}, year={2017}, pages={2998–3001} } @article{gordon_koo_deng_kohler_whangbo_2017, title={Group of quantum bits acting as a bit using a single-domain ferromagnet of uniaxial magnetic ions}, volume={18}, DOI={10.1002/cphc.201700609}, number={16}, journal={Chemphyschem}, author={Gordon, E. E. and Koo, H. J. and Deng, S. Q. and Kohler, R. and Whangbo, M. H.}, year={2017}, pages={2147–2150} } @article{clune_hughey_lee_abhyankar_ding_dalal_whangbo_singleton_musfeldt_2017, title={Magnetic field-temperature phase diagram of multiferroic [(CH3)(2)NH2]Mn(HCOO)(3)}, volume={96}, DOI={10.1103/physrevb.96.104424}, number={10}, journal={Physical Review B}, author={Clune, A. J. and Hughey, K. D. and Lee, C. and Abhyankar, N. and Ding, X. and Dalal, N. S. and Whangbo, M. H. and Singleton, J. and Musfeldt, J. L.}, year={2017} } @article{al-wahish_o'neal_lee_fan_hughey_yokosuk_clune_li_schlueter_manson_et al._2017, title={Magnetic phase transitions and magnetoelastic coupling in S=1/2 Heisenberg antiferromagnets}, volume={95}, DOI={10.1103/physrevb.95.104437}, number={10}, journal={Physical Review B}, author={al-Wahish, A. and O'Neal, K. R. and Lee, C. and Fan, S. and Hughey, K. and Yokosuk, M. O. and Clune, A. J. and Li, Z. and Schlueter, J. A. and Manson, J. L. and et al.}, year={2017} } @article{bussmann-holder_kohler_simon_whangbo_bianconi_2017, title={Multigap superconductivity at extremely high temperature: a model for the case of pressurized h2s}, volume={30}, DOI={10.1007/s10948-016-3947-7}, number={1}, journal={Journal of Superconductivity and Novel Magnetism}, author={Bussmann-Holder, A. and Kohler, J. and Simon, A. and Whangbo, M. and Bianconi, A.}, year={2017}, pages={151–156} } @article{behrh_isobe_massuyeau_serier-brault_gordon_koo_whangbo_gautier_jobic_2017, title={Oxygen-vacancy-induced midgap states responsible for the fluorescence and the long-lasting phosphorescence of the inverse spinel Mg(Mg,Sn)O-4}, volume={29}, DOI={10.1021/acs.chemmater.6b03906}, number={3}, journal={Chemistry of Materials}, author={Behrh, G. K. and Isobe, M. and Massuyeau, F. and Serier-Brault, H. and Gordon, E. E. and Koo, H. J. and Whangbo, M. H. and Gautier, R. and Jobic, S.}, year={2017}, pages={1069–1075} } @article{jiang_liang_zheng_liu_wang_wang_zhang_qin_dai_whangbo_et al._2017, title={Photocatalytic reduction of CO2 to methanol by three-dimensional hollow structures of Bi2WO6 quantum dots}, volume={219}, DOI={10.1016/j.apcatb.2017.07.023}, journal={Applied Catalysis. B, Environmental}, author={Jiang, Z. Y. and Liang, X. Z. and Zheng, H. L. and Liu, Y. Y. and Wang, Z. Y. and Wang, P. and Zhang, X. Y. and Qin, X. Y. and Dai, Y. and Whangbo, M. H. and et al.}, year={2017}, pages={209–215} } @article{xu_mace_enriquez_bao_harrell_chen_whangbo_2017, title={Roles of reaction kinetics of CO2 on a PrBaCo2O5.5+delta surfaces}, volume={7}, DOI={10.1039/c7ra06362h}, number={64}, journal={RSC Advances}, author={Xu, X. and Mace, B. and Enriquez, E. and Bao, S. Y. and Harrell, Z. and Chen, C. L. and Whangbo, M. H.}, year={2017}, pages={40558–40562} } @article{lee_an_gordon_ji_park_shim_lim_whangbo_2017, title={Seebeck Coefficients of layered BiCuSeO Phases: analysis of their Hole-Density Dependence and Quantum Confinement Effect}, volume={29}, DOI={10.1021/acs.chemmater.7b00028}, number={5}, journal={Chemistry of Materials}, author={Lee, C. and An, T. H. and Gordon, E. E. and Ji, H. S. and Park, C. and Shim, J. H. and Lim, Y. S. and Whangbo, M. H.}, year={2017}, pages={2348–2354} } @article{koo_gordon_whangbo_2017, title={Single-domain ferromagnet of noncentrosymmetric uniaxial magnetic ions and magnetoelectric interaction}, volume={56}, DOI={10.1002/anie.201701699}, number={34}, journal={Angewandte Chemie [International Edition in English]}, author={Koo, H. J. and Gordon, E. E. and Whangbo, M. H.}, year={2017}, pages={10196–10199} } @article{golubev_dinnebier_schulz_kremer_langbein_senyshyn_law_hansen_koo_whangbo_2017, title={Structural and magnetic properties of the trirutile-type 1D-Heisenberg anti-ferromagnet CuTa2O6}, volume={56}, DOI={10.1021/acs.inorgchem.7b00421}, number={11}, journal={Inorganic Chemistry}, author={Golubev, A. and Dinnebier, R. E. and Schulz, A. and Kremer, R. K. and Langbein, H. and Senyshyn, A. and Law, J. M. and Hansen, T. C. and Koo, H. J. and Whangbo, M. H.}, year={2017}, pages={6318–6329} } @article{cheng_gordon_whangbo_deng_2017, title={Superconductivity induced by oxygen doping in Y2O2Bi}, volume={56}, DOI={10.1002/anie.201701427}, number={34}, journal={Angewandte Chemie [International Edition in English]}, author={Cheng, X. Y. and Gordon, E. E. and Whangbo, M. H. and Deng, S. Q.}, year={2017}, pages={10123–10126} } @article{xu_an_liu_huang_qin_zhang_dai_whangbo_2016, title={An efficient visible-light photocatalyst made from a nonpolar layered semiconductor by grafting electron-withdrawing organic molecules to its surface}, volume={52}, DOI={10.1039/c6cc07849d}, number={92}, journal={Chemical Communications}, author={Xu, B. Y. and An, Y. and Liu, Y. Y. and Huang, B. B. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2016}, pages={13507–13510} } @misc{stroppa_barone_di sante_cuoco_picozzi_whangbo_2016, title={Analogies between Jahn-Teller and Rashba spin physics}, volume={116}, DOI={10.1002/qua.25209}, number={20}, journal={International Journal of Quantum Chemistry}, author={Stroppa, A. and Barone, P. and Di Sante, D. and Cuoco, M. and Picozzi, S. and Whangbo, M. H.}, year={2016}, pages={1442–1450} } @article{kovrugin_gordon_kasapbasi_whangbo_colmont_siidra_colis_krivovichev_mentre_2016, title={Bonding scheme, hydride character, and magnetic paths of (HPO3)(2-) versus (SeO3)(2-) building units in solids}, volume={120}, DOI={10.1021/acs.jpcc.5b10889}, number={3}, journal={Journal of Physical Chemistry. C}, author={Kovrugin, V. M. and Gordon, E. E. and Kasapbasi, E. E. and Whangbo, M. H. and Colmont, M. and Siidra, O. I. and Colis, S. and Krivovichev, S. V. and Mentre, O.}, year={2016}, pages={1650–1656} } @article{caslin_kremer_razavi_hanfland_syassen_gordon_whangbo_2016, title={Competing Jahn-Teller distortions and hydrostatic pressure effects in the quasi-one-dimensional quantum ferromagnet CuAs2O4}, volume={93}, DOI={10.1103/physrevb.93.022301}, number={2}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Caslin, K. and Kremer, R. K. and Razavi, F. S. and Hanfland, M. and Syassen, K. and Gordon, E. E. and Whangbo, M. H.}, year={2016} } @article{gordon_kohler_whangbo_2016, title={Condensed-matter equation of states covering a wide region of pressure studied experimentally}, volume={6}, journal={Scientific Reports}, author={Gordon, E. E. and Kohler, J. and Whangbo, M. H.}, year={2016} } @article{jiang_liu_jing_huang_zhang_qin_dai_whangbo_2016, title={Enhancing the photocatalytic activity of BiVO4 for oxygen evolution by Ce doping: Ce3+ ions as hole traps}, volume={120}, DOI={10.1021/acs.jpcc.5b10856}, number={4}, journal={Journal of Physical Chemistry. C}, author={Jiang, Z. Y. and Liu, Y. Y. and Jing, T. and Huang, B. B. and Zhang, X. Y. and Qin, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2016}, pages={2058–2063} } @article{lee_hong_son_kan_shim_whangbo_2016, title={Magnetic structure of (C5H12N)CuBr3: origin of the uniform Heisenberg chain behavior and the magnetic anisotropy of the Cu2+ (S=1/2) ions}, volume={6}, DOI={10.1039/c5ra26341g}, number={27}, journal={RSC Advances}, author={Lee, C. and Hong, J. and Son, W. J. and Kan, E. and Shim, J. H. and Whangbo, M. H.}, year={2016}, pages={22722–22727} } @article{bruyer_di sante_barone_stroppa_whangbo_picozzi_2016, title={Possibility of combining ferroelectricity and Rashba-like spin splitting in monolayers of the 1T-type transition-metal dichalcogenides MX2 (M = Mo, W; X = S, Se, Te)}, volume={94}, DOI={10.1103/physrevb.94.195402}, number={19}, journal={Physical Review B}, author={Bruyer, E. and Di Sante, D. and Barone, P. and Stroppa, A. and Whangbo, M. H. and Picozzi, S.}, year={2016} } @article{gordon_xiang_kohler_whangbo_2016, title={Spin orientations of the spin-half Ir4+ ions in Sr3NiIrO6, Sr2IrO4, and Na2IrO3: Density functional, perturbation theory, and Madelung potential analyses}, volume={144}, number={11}, journal={Journal of Chemical Physics}, author={Gordon, E. E. and Xiang, H. J. and Kohler, J. and Whangbo, M. H.}, year={2016} } @article{o'neal_holinsworth_chen_peterson_carreiro_lee_manson_whangbo_li_liu_et al._2016, title={Spin-lattice coupling in [Ni(HF2)(pyrazine)(2)]SbF6 involving the HF2- superexchange pathway}, volume={55}, DOI={10.1021/acs.inorgchem.6b01679}, number={23}, journal={Inorganic Chemistry}, author={O'Neal, K. R. and Holinsworth, B. S. and Chen, Z. G. and Peterson, P. K. and Carreiro, K. E. and Lee, C. and Manson, J. L. and Whangbo, M. H. and Li, Z. G. and Liu, Z. X. and et al.}, year={2016}, pages={12172–12178} } @article{gordon_xu_xiang_bussmann-holder_kremer_simon_kohler_whangbo_2016, title={Structure and composition of the 200K-superconducting phase of H2S at ultrahigh pressure: The perovskite (SH-)(H3S+)}, volume={55}, DOI={10.1002/anie.201511347}, number={11}, journal={Angewandte Chemie [International Edition in English]}, author={Gordon, E. E. and Xu, K. and Xiang, H. J. and Bussmann-Holder, A. and Kremer, R. K. and Simon, A. and Kohler, J. and Whangbo, M. H.}, year={2016}, pages={3682–3684} } @article{bao_xu_enriquez_mace_chen_kelliher_chen_zhang_whangbo_dong_et al._2015, title={Atomically layer-by-layer diffusion of oxygen/hydrogen in highly epitaxial PrBaCo2O5.5+delta thin films}, volume={107}, number={24}, journal={Applied Physics Letters}, author={Bao, S. Y. and Xu, X. and Enriquez, E. and Mace, B. E. and Chen, G. and Kelliher, S. P. and Chen, C. L. and Zhang, Y. M. and Whangbo, M. 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H. and Picozzi, S.}, year={2015} } @article{li_jing_liu_huang_dai_zhang_qin_whangbo_2015, title={Enhancing the efficiency of water oxidation by boron-doped BIVO4 under visible light: Hole trapping by BO4 tetrahedra}, volume={80}, DOI={10.1002/cplu.201500110}, number={7}, journal={Chempluschem}, author={Li, Y. Q. and Jing, T. and Liu, Y. Y. and Huang, B. B. and Dai, Y. and Zhang, X. Y. and Qin, X. Y. and Whangbo, M. H.}, year={2015}, pages={1113–1118} } @article{ma_dai_wei_huang_whangbo_2015, title={Insights into how fluorine-adsorption and n-type doping affect the relative stability of the (001) and (101) surfaces of TiO2: Enhancing the exposure of more active but thermodynamically less stable (001)}, volume={6}, DOI={10.1021/acs.jpclett.5b00595}, number={10}, journal={Journal of Physical Chemistry Letters}, author={Ma, X. C. and Dai, Y. and Wei, W. and Huang, B. B. and Whangbo, M. H.}, year={2015}, pages={1876–1882} } @article{wei_dai_huang_whangbo_jacob_2015, title={Loss of linear band dispersion and trigonal structure in silicene on Ir(111)}, volume={6}, DOI={10.1021/acs.jpclett.5b00106}, number={6}, journal={Journal of Physical Chemistry Letters}, author={Wei, W. and Dai, Y. and Huang, B. B. and Whangbo, M. H. and Jacob, T.}, year={2015}, pages={1065–1070} } @article{zvereva_nalbandyan_evstigneeva_koo_whangbo_ushakov_medvedev_medvedeva_gridina_yalovega_et al._2015, title={Magnetic and electrode properties, structure and phase relations of the layered triangular-lattice tellurate Li4NiTeO6}, volume={225}, DOI={10.1016/j.jssc.2014.12.003}, journal={Journal of Solid State Chemistry}, author={Zvereva, E. A. and Nalbandyan, V. B. and Evstigneeva, M. A. and Koo, H. J. and Whangbo, M. H. and Ushakov, A. V. and Medvedev, B. S. and Medvedeva, L. I. and Gridina, N. A. and Yalovega, G. E. and et al.}, year={2015}, pages={89–96} } @article{nalbandyan_zvereva_nikulin_shukaev_whangbo_koo_abdel-hafiez_chen_koo_vasiliev_et al._2015, title={New phase of MnSb2O6 prepared by ion exchange: Structural, magnetic, and thermodynamic properties}, volume={54}, DOI={10.1021/ic502666c}, number={4}, journal={Inorganic Chemistry}, author={Nalbandyan, V. B. and Zvereva, E. A. and Nikulin, A. Y. and Shukaev, I. L. and Whangbo, M. H. and Koo, H. J. and Abdel-Hafiez, M. and Chen, X. J. and Koo, C. and Vasiliev, A. N. and et al.}, year={2015}, pages={1705–1711} } @article{wang_huang_li_wang_qin_zhang_dai_whangbo_2015, title={On structural features necessary for near-IR-light photocatalysts}, volume={21}, DOI={10.1002/chem.201501477}, number={39}, journal={Chemistry (Weinheim An Der Bergstrasse, Germany)}, author={Wang, G. and Huang, B. B. and Li, Z. J. and Wang, Z. Y. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2015}, pages={13583–13587} } @article{kim_yu_kim_koo_whangbo_2015, title={On why the two polymorphs of NaFePO4 exhibit widely different magnetic structures: Density functional analysis}, volume={54}, DOI={10.1021/acs.inorgchem.5b00577}, number={10}, journal={Inorganic Chemistry}, author={Kim, H. H. and Yu, I. H. and Kim, H. S. and Koo, H. J. and Whangbo, M. H.}, year={2015}, pages={4966–4971} } @article{lee_hong_stroppa_whangbo_shim_2015, title={Organic-inorganic hybrid perovskites ABI(3) (A = CH3NH3, NH2CHNH2; B = Sn, Pb) as potential thermoelectric materials: a density functional evaluationt}, volume={5}, DOI={10.1039/c5ra12536g}, number={96}, journal={RSC Advances}, author={Lee, C. and Hong, J. and Stroppa, A. and Whangbo, M. H. and Shim, J. H.}, year={2015}, pages={78701–78707} } @article{galliez_deniard_payen_lambertin_bart_koo_whangbo_jobic_2015, title={Pair distribution function and density functional theory analyses of hydrogen trapping by gamma-MnO2}, volume={54}, DOI={10.1021/ic5026334}, number={4}, journal={Inorganic Chemistry}, author={Galliez, K. and Deniard, P. and Payen, C. and Lambertin, D. and Bart, F. and Koo, H. J. and Whangbo, M. H. and Jobic, S.}, year={2015}, pages={1194–1196} } @misc{whangbo_gordon_xiang_koo_lee_2015, title={Prediction of spin orientations in terms of HOMO-LUMO interactions using spin-orbit coupling as perturbation}, volume={48}, DOI={10.1021/acs.accounts.5b00408}, number={12}, journal={Accounts of Chemical Research}, author={Whangbo, M. H. and Gordon, E. E. and Xiang, H. and Koo, H. J. and Lee, C.}, year={2015}, pages={3080–3087} } @article{lee_kim_kim_rhee_whangbo_2015, title={Solution phase post-modification of a trimesic acid network on Au(111) with Zn2+ ions}, volume={51}, DOI={10.1039/c4cc08621j}, number={5}, journal={Chemical Communications}, author={Lee, J. and Kim, J. and Kim, H. and Rhee, C. K. and Whangbo, M. H.}, year={2015}, pages={873–876} } @article{canevet_fak_kremer_chun_enderle_gordon_bettis_whangbo_taylor_adroja_2015, title={Spin excitations in the two-dimensional strongly coupled dimer system malachite}, volume={91}, DOI={10.1103/physrevb.91.060402}, number={6}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Canevet, E. and Fak, B. and Kremer, R. K. and Chun, J. H. and Enderle, M. and Gordon, E. E. and Bettis, J. L. and Whangbo, M. H. and Taylor, J. W. and Adroja, D. T.}, year={2015} } @article{wang_huang_li_lou_wang_dai_whangbo_2015, title={Synthesis and characterization of ZnS with controlled amount of S vacancies for photocatalytic H-2 production under visible light}, volume={5}, journal={Scientific Reports}, author={Wang, G. and Huang, B. B. and Li, Z. J. and Lou, Z. Z. and Wang, Z. Y. and Dai, Y. and Whangbo, M. H.}, year={2015} } @article{read_gordon_smith_yeon_morrison_whangbo_loye_2015, title={Synthesis of the layered quaternary uranium-containing oxide Cs2Mn3U6O22 and characterization of its magnetic properties}, volume={54}, DOI={10.1021/acs.inorgchem.5b00552}, number={11}, journal={Inorganic Chemistry}, author={Read, C. M. and Gordon, E. E. and Smith, M. D. and Yeon, J. and Morrison, G. and Whangbo, M. H. and Loye, H. C.}, year={2015}, pages={5495–5503} } @article{whangbo_gordon_bettis_bussmann-holder_kohler_2015, title={Tolerance factor and cation-anion orbital interactions differentiating the polar and antiferrodistortive structures of perovskite oxides ABO(3)}, volume={641}, DOI={10.1002/zaac.201500058}, number={6}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Whangbo, M. H. and Gordon, E. E. and Bettis, J. L. and Bussmann-Holder, A. and Kohler, J.}, year={2015}, pages={1043–1052} } @article{bussmann-holder_kohler_whangbo_2015, title={Unexpected precursor effects to the structural phase transition in EuTiO3}, volume={641}, DOI={10.1002/zaac.201400596}, number={2}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Bussmann-Holder, A. and Kohler, J. and Whangbo, M. H.}, year={2015}, pages={180–183} } @article{lou_huang_wang_ma_zhang_zhang_qin_dai_whangbo_2014, title={Ag6Si2O7: A silicate photocatalyst for the visible region}, volume={26}, DOI={10.1021/cm500657n}, number={13}, journal={Chemistry of Materials}, author={Lou, Z. Z. and Huang, B. B. and Wang, Z. Y. and Ma, X. C. and Zhang, R. and Zhang, X. Y. and Qin, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2014}, pages={3873–3875} } @article{lee_kang_hong_shim_whangbo_2014, title={Analysis of the difference between the pyroxenes LiFeSi2O6 and LiFeGe2O6 in their spin order, spin orientation, and ferrotoroidal order}, volume={26}, DOI={10.1021/cm5001413}, number={4}, journal={Chemistry of Materials}, author={Lee, C. and Kang, J. and Hong, J. and Shim, J. H. and Whangbo, M. H.}, year={2014}, pages={1745–1750} } @article{caslin_kremer_razavi_schulz_munoz_pertlik_liu_whangbo_law_2014, title={Characterization of the spin-1/2 linear-chain ferromagnet CuAs2O4}, volume={89}, DOI={10.1103/physrevb.89.014412}, number={1}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Caslin, K. and Kremer, R. K. and Razavi, F. S. and Schulz, A. and Munoz, A. and Pertlik, F. and Liu, J. and Whangbo, M. H. and Law, J. M.}, year={2014} } @article{hu_johnsson_law_bettis_whangbo_kremer_2014, title={Crystal structure and magnetic properties of FeSeO3F-alternating antiferromagnetic S=5/2 chains}, volume={53}, DOI={10.1021/ic5003995}, number={8}, journal={Inorganic Chemistry}, author={Hu, S. C. and Johnsson, M. and Law, J. M. and Bettis, J. L. and Whangbo, M. H. and Kremer, R. K.}, year={2014}, pages={4250–4256} } @article{koo_whangbo_2014, title={Density functional investigation of why Ba2BiFeS5 and Ba2SbFeS5 differ in their magnetic properties}, volume={360}, DOI={10.1016/j.jmmm.2014.02.024}, journal={Journal of Magnetism and Magnetic Materials}, author={Koo, H. J. and Whangbo, M. H.}, year={2014}, pages={152–156} } @article{ma_dai_yu_lou_huang_whangbo_2014, title={Electron hole pair generation of the visible-light plasmonic photocatalyst Ag@AgCl: Enhanced optical transitions involving midgap defect states of AgCl}, volume={118}, DOI={10.1021/jp5023604}, number={23}, journal={Journal of Physical Chemistry. C}, author={Ma, X. C. and Dai, Y. and Yu, L. and Lou, Z. Z. and Huang, B. B. and Whangbo, M. H.}, year={2014}, pages={12133–12140} } @article{lee_lee_lee_whangbo_2014, title={Evaluating the Curie-Weiss temperature of a magnetic system composed of nonequivalent magnetic ions in terms of spin exchange constants}, volume={35}, DOI={10.5012/bkcs.2014.35.5.1277}, number={5}, journal={Bulletin of the Korean Chemical Society}, author={Lee, K. H. and Lee, J. Y. and Lee, C. and Whangbo, M. H.}, year={2014}, pages={1277–1278} } @article{mccabe_stock_bettis_whangbo_evans_2014, title={Magnetism of the Fe2+ and Ce3+ sublattices in Ce2O2FeSe2: A combined neutron powder diffraction, inelastic neutron scattering, and density functional study}, volume={90}, DOI={10.1103/physrevb.90.235115}, number={23}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={McCabe, E. E. and Stock, C. and Bettis, J. L. and Whangbo, M. H. and Evans, J. S. 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H.}, year={2014} } @article{law_koo_whangbo_brucher_pomjakushin_kremer_2014, title={Strongly correlated one-dimensional magnetic behavior of NiTa2O6}, volume={89}, DOI={10.1103/physrevb.89.014423}, number={1}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Law, J. M. and Koo, H. J. and Whangbo, M. H. and Brucher, E. and Pomjakushin, V. and Kremer, R. K.}, year={2014} } @article{stroppa_di sante_barone_bokdam_kresse_franchini_whangbo_picozzi_2014, title={Tunable ferroelectric polarization and its interplay with spin-orbit coupling in tin iodide perovskites}, volume={5}, journal={Nature Communications}, author={Stroppa, A. and Di Sante, D. and Barone, P. and Bokdam, M. and Kresse, G. and Franchini, C. and Whangbo, M. H. and Picozzi, S.}, year={2014} } @article{david_kabbour_pautrat_touati_whangbo_mentre_2014, title={Two-orbital three-electron stabilizing interaction for direct Co2+ - As3+ bonds involving square-planar CoO4 in BaCoAs2O5}, volume={53}, DOI={10.1002/anie.201311183}, number={12}, journal={Angewandte Chemie [International Edition in English]}, author={David, R. and Kabbour, H. and Pautrat, A. and Touati, N. and Whangbo, M. H. and Mentre, O.}, year={2014}, pages={3111–3114} } @article{bao_ma_chen_xu_enriquez_chen_zhang_bettis_whangbo_dong_et al._2014, title={Ultrafast atomic layer-by-layer oxygen vacancy-exchange diffusion in double-perovskite LnBaCo(2)O(5.5+delta) thin films}, volume={4}, journal={Scientific Reports}, author={Bao, S. Y. and Ma, C. R. and Chen, G. and Xu, X. and Enriquez, E. and Chen, C. L. and Zhang, Y. M. and Bettis, J. L. and Whangbo, M. H. and Dong, C. and et al.}, year={2014} } @article{wang_bao_liu_collins_ma_liu_chen_dong_whangbo_guo_et al._2014, title={Ultrafast chemical dynamic behavior in highly epitaxial LaBaCo2O5+delta thin films}, volume={2}, DOI={10.1039/c4tc00492b}, number={28}, journal={Journal of Materials Chemistry C}, author={Wang, H. B. and Bao, S. Y. and Liu, J. and Collins, G. and Ma, C. R. and Liu, M. and Chen, C. L. and Dong, C. and Whangbo, M. H. and Guo, H. M. and et al.}, year={2014}, pages={5660–5666} } @article{kim_rhee_koo_kasapbasi_whangbo_2013, title={A Contoured network of anionic trimesic acids on Au(111) and its host-guest chemistry}, volume={117}, DOI={10.1021/jp403203s}, number={44}, journal={Journal of Physical Chemistry. C}, author={Kim, J. and Rhee, C. K. and Koo, H. J. and Kasapbasi, E. E. and Whangbo, M. H.}, year={2013}, pages={22636–22643} } @article{jin_kim_jo_bettis_koo_whangbo_hwang_2013, title={A crucial role of bond covalency competition in determining the bandgap and photocatalytic performance of silver oxosalts}, volume={117}, DOI={10.1021/jp4101784}, number={50}, journal={Journal of Physical Chemistry. C}, author={Jin, X. and Kim, I. Y. and Jo, Y. K. and Bettis, J. L. and Koo, H. J. and Whangbo, M. H. and Hwang, S. J.}, year={2013}, pages={26509–26516} } @article{david_pautrat_filimonov_kabbour_vezin_whangbo_mentre_2013, title={Across the structural re-entrant transition in BaFe2(PO4)(2): Influence of the two-dimensional ferromagnetism}, volume={135}, DOI={10.1021/ja404697b}, number={35}, journal={Journal of the American Chemical Society}, author={David, R. and Pautrat, A. and Filimonov, D. and Kabbour, H. and Vezin, H. and Whangbo, M. H. and Mentre, O.}, year={2013}, pages={13023–13029} } @article{lapidus_manson_park_clement_ghannadzadeh_goddard_lancaster_moller_blundell_telling_et al._2013, title={Antiferromagnetic ordering through a hydrogen-bonded network in the molecular solid CuF2(H2O)(2)(3-chloropyridine)}, volume={49}, DOI={10.1039/c2cc37444g}, number={5}, journal={Chemical Communications}, author={Lapidus, S. H. and Manson, J. L. and Park, H. and Clement, A. J. and Ghannadzadeh, S. and Goddard, P. and Lancaster, T. and Moller, J. S. and Blundell, S. J. and Telling, M. T. F. and et al.}, year={2013}, pages={499–501} } @article{wang_huang_ma_wang_qin_zhang_dai_whangbo_2013, title={Cu2(OH)PO4, a near-infrared-activated photocatalyst}, volume={52}, DOI={10.1002/anie.201301306}, number={18}, journal={Angewandte Chemie [International Edition in English]}, author={Wang, G. and Huang, B. B. and Ma, X. C. and Wang, Z. Y. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2013}, pages={4810–4813} } @article{wang_jain_choi_tol_cheetham_kroto_koo_zhou_hwang_choi_et al._2013, title={Dimethylammonium copper formate [(CH3)(2)NH2]Cu(HCOO)(3): A metal-organic framework with quasi-one-dimensional antiferromagnetism and magnetostriction}, volume={87}, DOI={10.1103/physrevb.87.224406}, number={22}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Wang, Z. X. and Jain, P. and Choi, K. Y. and Tol, J. and Cheetham, A. K. and Kroto, H. W. and Koo, H. J. and Zhou, H. and Hwang, J. M. and Choi, E. S. and et al.}, year={2013} } @article{wang_huang_ma_wang_qin_zhang_dai_whangbo_2013, title={Efficient separation of photogenerated electron-hole pairs by the combination of a heterolayered structure and internal polar field in pyroelectric BiOIO3 nanoplates}, volume={19}, DOI={10.1002/chem.201302884}, number={44}, journal={Chemistry (Weinheim An Der Bergstrasse, Germany)}, author={Wang, W. J. and Huang, B. B. and Ma, X. C. and Wang, Z. Y. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2013}, pages={14777–14780} } @article{lee_hong_whangbo_shim_2013, title={Enhancing the thermoelectric properties of layered transition-metal dichalcogenides 2H-MQ(2) (M = Mo, W; Q = S, Se, Te) by layer mixing: Density functional investigation}, volume={25}, DOI={10.1021/cm402281n}, number={18}, journal={Chemistry of Materials}, author={Lee, C. and Hong, J. and Whangbo, M. H. and Shim, J. H.}, year={2013}, pages={3745–3752} } @article{jeong_kim_cha_son_park_kim_cho_whangbo_yoo_kim_2013, title={Hydrogen sensing under ambient conditions using SnO2 nanowires: Synergetic effect of Pd/Sn codeposition}, volume={13}, DOI={10.1021/nl402998g}, number={12}, journal={Nano Letters}, author={Jeong, S. H. and Kim, S. and Cha, J. and Son, M. S. and Park, S. H. and Kim, H. Y. and Cho, M. H. and Whangbo, M. H. and Yoo, K. H. and Kim, S. J.}, year={2013}, pages={5938–5943} } @article{lou_huang_wang_qin_zhang_liu_zhang_dai_whangbo_2013, title={Interface kinetic diffusion reaction leading to fast and continuous generation of AgCl nanocubes in NaCl solution}, volume={42}, number={42}, journal={Dalton Transactions (Cambridge, England : 2003)}, author={Lou, Z. Z. and Huang, B. B. and Wang, Z. Y. and Qin, X. Y. and Zhang, X. Y. and Liu, Y. Y. and Zhang, R. and Dai, Y. and Whangbo, M. H.}, year={2013}, pages={15219–15225} } @article{ma_liu_collins_wang_bao_xu_enriquez_chen_lin_whangbo_2013, title={Magnetic and electrical transport properties of LaBaCo2O5.5+delta thin films on vicinal (001) SrTiO3 surfaces}, volume={5}, DOI={10.1021/am302553y}, number={2}, journal={ACS Applied Materials & Interfaces}, author={Ma, C. R. and Liu, M. and Collins, G. and Wang, H. B. and Bao, S. Y. and Xu, X. and Enriquez, E. and Chen, C. L. and Lin, Y. and Whangbo, M. H.}, year={2013}, pages={451–455} } @article{nenert_koo_colin_bauer_bellitto_ritter_righini_whangbo_2013, title={Magnetic order through super-superexchanges in the polar magnetoelectric organic-inorganic hybrid Cr[(D3N-(CH2)(2)-PO3)(Cl)(D2O)]}, volume={52}, DOI={10.1021/ic301874v}, number={2}, journal={Inorganic Chemistry}, author={Nenert, G. and Koo, H. J. and Colin, C. V. and Bauer, E. M. and Bellitto, C. and Ritter, C. and Righini, G. and Whangbo, M. H.}, year={2013}, pages={753–760} } @article{xiang_lee_koo_gong_whangbo_2013, title={Magnetic properties and energy-mapping analysis}, volume={42}, DOI={10.1039/c2dt31662e}, number={4}, journal={Dalton Transactions (Cambridge, England : 2003)}, author={Xiang, H. J. and Lee, C. and Koo, H. J. and Gong, X. G. and Whangbo, M. H.}, year={2013}, pages={823–853} } @article{nenert_bettis_kremer_ben yahia_ritter_gaudin_isnard_whangbo_2013, title={Magnetic properties of the RbMnPO4 zeolite-ABW-type material: A frustrated zigzag spin chain}, volume={52}, DOI={10.1021/ic401408f}, number={16}, journal={Inorganic Chemistry}, author={Nenert, G. and Bettis, J. and Kremer, R. and Ben Yahia, H. and Ritter, C. and Gaudin, E. and Isnard, O. and Whangbo, M. H.}, year={2013}, pages={9627–9635} } @article{guguchia_caslin_kremer_keller_shengelaya_maisuradze_bettis_kohler_bussmann-holder_whangbo_2013, title={Nonlinear pressure dependence of T-N in almost multiferroic EuTiO3}, volume={25}, number={37}, journal={Journal of Physics. Condensed Matter}, author={Guguchia, Z. and Caslin, K. and Kremer, R. K. and Keller, H. and Shengelaya, A. and Maisuradze, A. and Bettis, J. L. and Kohler, J. and Bussmann-Holder, A. and Whangbo, M. H.}, year={2013} } @article{hakouk_deniard_lajaunie_guillot-deudon_harel_wang_huang_koo_whangbo_jobic_et al._2013, title={Novel soft-chemistry route of Ag2Mo3O10 center dot 2H(2)O nanowires and in situ photogeneration of a Ag@Ag2Mo3O10 center dot 2H(2)O plasmonic heterostructure}, volume={52}, DOI={10.1021/ic400343v}, number={11}, journal={Inorganic Chemistry}, author={Hakouk, K. and Deniard, P. and Lajaunie, L. and Guillot-Deudon, C. and Harel, S. and Wang, Z. Y. and Huang, B. B. and Koo, H. J. and Whangbo, M. H. and Jobic, S. and et al.}, year={2013}, pages={6440–6449} } @article{kasapbasi_whangbo_2013, title={On the nature of the photochemical reaction of polypyridyl Ru(II) complexes leading to sunlight-to-chemical energy conversion: density functional analysis}, volume={3}, number={24}, journal={RSC Advances}, author={Kasapbasi, E. E. and Whangbo, M. H.}, year={2013}, pages={9414–9418} } @article{brinzari_chen_sun_liu_tung_wang_schlueter_singleton_manson_whangbo_et al._2013, title={Quantum critical transition amplifies magnetoelastic coupling in Mn[N(CN)(2)](2)}, volume={110}, DOI={10.1103/physrevlett.110.237202}, number={23}, journal={Physical Review Letters}, author={Brinzari, T. V. and Chen, P. and Sun, Q. C. and Liu, J. and Tung, L. C. and Wang, Y. and Schlueter, J. A. and Singleton, J. and Manson, J. L. and Whangbo, M. H. and et al.}, year={2013} } @article{bykov_zhang_schonleber_wolfel_ali_smaalen_glaum_koo_whangbo_reuvekamp_et al._2013, title={Spin-Peierls distortions in TiPO4}, volume={88}, DOI={10.1103/physrevb.88.184420}, number={18}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Bykov, M. and Zhang, J. and Schonleber, A. and Wolfel, A. and Ali, S. I. and Smaalen, S. and Glaum, R. and Koo, H. J. and Whangbo, M. H. and Reuvekamp, P. 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H.}, year={2013}, pages={114–120} } @article{xiang_wang_whangbo_gong_2013, title={Unified model of ferroelectricity induced by spin order}, volume={88}, DOI={10.1103/physrevb.88.054404}, number={5}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Xiang, H. J. and Wang, P. S. and Whangbo, M. H. and Gong, X. G.}, year={2013} } @article{koo_whangbo_2012, title={Analysis of the magnetic structure of the manganese oxychalcogenides R2Mn2Se2O (R=LaO, BaF) by density functional calculations}, volume={324}, DOI={10.1016/j.jmmm.2012.06.035}, number={22}, journal={Journal of Magnetism and Magnetic Materials}, author={Koo, H. J. and Whangbo, M. H.}, year={2012}, pages={3859–3862} } @article{zhao_hung_li_chen_wu_kremer_banks_simon_whangbo_lee_et al._2012, title={CuBr2-A New Multiferroic Material with High Critical Temperature}, volume={24}, DOI={10.1002/adma.201200734}, number={18}, journal={Advanced Materials}, author={Zhao, L. and Hung, T. L. and Li, C. C. and Chen, Y. Y. and Wu, M. K. and Kremer, R. K. and Banks, M. G. and Simon, A. and Whangbo, M. H. and Lee, C. and et al.}, year={2012}, pages={2469–2473} } @article{koo_lee_whangbo_2012, title={Density functional analysis of the magnetic structures of Sr2MGe2O7 (M = Mn, Co)}, volume={324}, DOI={10.1016/j.jmmm.2012.06.001}, number={22}, journal={Journal of Magnetism and Magnetic Materials}, author={Koo, H. J. and Lee, C. and Whangbo, M. H.}, year={2012}, pages={3716–3718} } @article{kasapbasi_whangbo_2012, title={Density functional investigation of the water oxidation by iron complexes based on tetradentate nitrogen ligands}, volume={51}, DOI={10.1021/ic3013359}, number={20}, journal={Inorganic Chemistry}, author={Kasapbasi, E. E. and Whangbo, M. H.}, year={2012}, pages={10850–10855} } @article{lu_whangbo_dong_gong_xiang_2012, title={Giant ferroelectric polarization of CaMn7O12 induced by a combined effect of Dzyaloshinskii-Moriya interaction and exchange striction}, volume={108}, DOI={10.1103/physrevlett.108.187204}, number={18}, journal={Physical Review Letters}, author={Lu, X. Z. and Whangbo, M. H. and Dong, S. and Gong, X. G. and Xiang, H. J.}, year={2012} } @article{liu_ma_liu_collins_chen_he_jiang_meletis_sun_jacobson_et al._2012, title={Giant magnetoresistance and anomalous magnetic properties of highly epitaxial ferromagnetic LaBaCo2O5.5+delta thin films on (001) MgO}, volume={4}, DOI={10.1021/am301427c}, number={10}, journal={ACS Applied Materials & Interfaces}, author={Liu, M. and Ma, C. R. and Liu, J. and Collins, G. and Chen, C. L. and He, J. and Jiang, J. C. and Meletis, E. I. and Sun, L. and Jacobson, A. J. and et al.}, year={2012}, pages={5524–5528} } @article{li_whangbo_gong_xiang_2012, title={Helicoidal magnetic structure and ferroelectric polarization in Cu3Nb2O8}, volume={86}, DOI={10.1103/physrevb.86.174401}, number={17}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Li, Z. L. and Whangbo, M. H. and Gong, X. G. and Xiang, H. J.}, year={2012} } @article{zheng_huang_lu_wang_qin_zhang_dai_whangbo_2012, title={Hydrogenated titania: synergy of surface modification and morphology improvement for enhanced photocatalytic activity}, volume={48}, number={46}, journal={Chemical Communications}, author={Zheng, Z. K. and Huang, B. B. and Lu, J. B. and Wang, Z. Y. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2012}, pages={5733–5735} } @article{schlueter_park_halder_armand_dunmars_chapman_manson_singleton_mcdonald_plonczak_et al._2012, title={Importance of Halogen center dot center dot center dot Halogen Contacts for the Structural and Magnetic Properties of CuX2(pyrazine-N,N '-dioxide)(H2O)(2) (X = Cl and Br)}, volume={51}, number={4}, journal={Inorganic Chemistry}, author={Schlueter, J. A. and Park, H. and Halder, G. J. and Armand, W. R. and Dunmars, C. and Chapman, K. W. and Manson, J. L. and Singleton, J. and McDonald, R. and Plonczak, A. and et al.}, year={2012}, pages={2121–2129} } @article{meddar_josse_maglione_guiet_la_deniard_decourt_lee_tian_jobic_et al._2012, title={Increasing the phase-transition temperatures in spin-frustrated multiferroic MnWO(4) by Mo Doping}, volume={24}, DOI={10.1021/cm2031653}, number={2}, journal={Chemistry of Materials}, author={Meddar, L. and Josse, M. and Maglione, M. and Guiet, A. and La, C. and Deniard, P. and Decourt, R. and Lee, C. 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B, Condensed Matter and Materials Physics}, author={Lee, C. and Liu, J. and Whangbo, M. H. and Koo, H. J. and Kremer, R. K. and Simon, A.}, year={2012} } @article{koo_kremer_whangbo_2012, title={Non-idle-spin behavior and field-induced magnetic transitions of the triple chain magnet Cu-3(OH)(4)SO4}, volume={81}, number={6}, journal={Journal of the Physical Society of Japan}, author={Koo, H. J. and Kremer, R. K. and Whangbo, M. H.}, year={2012} } @article{tong_kohler_simon_lee_whangbo_2012, title={Optical properties of the orchid colored silver(II) fluoride Cs2AgF4}, volume={638}, DOI={10.1002/zaac.201200315}, number={11}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Tong, J. W. and Kohler, J. and Simon, A. and Lee, C. and Whangbo, M. H.}, year={2012}, pages={1792–1795} } @article{wang_huang_dai_whangbo_2012, title={Plasmonic photocatalysts: Harvesting visible light with noble metal nanoparticles}, volume={14}, number={28}, journal={Physical Chemistry Chemical Physics}, author={Wang, P. and Huang, B. B. and Dai, Y. and Whangbo, M. H.}, year={2012}, pages={9813–9825} } @article{yang_li_lu_whangbo_wei_gong_xiang_2012, title={Strong Dzyaloshinskii-Moriya interaction and origin of ferroelectricity in Cu2OSeO3}, volume={109}, DOI={10.1103/physrevlett.109.107203}, number={10}, journal={Physical Review Letters}, author={Yang, J. H. and Li, Z. L. and Lu, X. Z. and Whangbo, M. H. and Wei, S. H. and Gong, X. G. and Xiang, H. J.}, year={2012} } @article{ben yahia_shikano_koike_tatsumi_kobayashi_kawaji_avdeev_miiller_ling_liu_et al._2012, title={Synthesis and characterization of the crystal structure and magnetic properties of the new fluorophosphate LiNaCo[PO4]F}, volume={51}, DOI={10.1021/ic300374w}, number={16}, journal={Inorganic Chemistry}, author={Ben Yahia, H. and Shikano, M. and Koike, S. and Tatsumi, K. and Kobayashi, H. and Kawaji, H. and Avdeev, M. and Miiller, W. and Ling, C. D. and Liu, J. and et al.}, year={2012}, pages={8729–8738} } @article{zhang_dai_yu_guo_huang_whangbo_2012, title={The surface termination effect on the quantum confinement and electron affinities of 3C-SiC quantum dots: a first-principles study}, volume={4}, number={5}, journal={Nanoscale}, author={Zhang, Z. K. and Dai, Y. and Yu, L. and Guo, M. and Huang, B. B. and Whangbo, M. H.}, year={2012}, pages={1592–1597} } @article{kim_kim_rhee_kim_whangbo_2012, title={Tip-induced modification of polyoxometalate-dodecane thiol self-assembled monolayers on Au(111) during scanning tunneling microscopy imaging}, volume={33}, DOI={10.5012/bkcs.2012.33.9.3139}, number={9}, journal={Bulletin of the Korean Chemical Society}, author={Kim, J. and Kim, H. and Rhee, C. K. and Kim, J. and Whangbo, M. H.}, year={2012}, pages={3139–3141} } @article{manson_baldwin_scott_bendix_del sesto_goddard_kohama_tran_ghannadzadeh_singleton_et al._2012, title={[Ni(HF2)(3-Clpy)(4)]BF4 (py = pyridine): Evidence for spin exchange along strongly distorted F center dot center dot center dot H center dot center dot center dot F- bridges in a one-dimensional polymeric chain}, volume={51}, number={14}, journal={Inorganic Chemistry}, author={Manson, J. L. and Baldwin, A. G. and Scott, B. L. and Bendix, J. and Del Sesto, R. E. and Goddard, P. A. and Kohama, Y. and Tran, H. E. and Ghannadzadeh, S. and Singleton, J. and et al.}, year={2012}, pages={7520–7528} } @article{lee_kan_xiang_kremer_lee_hiroi_whangbo_2012, title={spin reorientation in the square-lattice antiferromagnets rmnaso (r = ce, nd): density functional analysis of the spin-exchange interactions between the rare-earth and transition-metal ions}, volume={51}, DOI={10.1021/ic300685d}, number={12}, journal={Inorganic Chemistry}, author={Lee, C. and Kan, E. and Xiang, H. and Kremer, R. K. and Lee, S. H. and Hiroi, Z. and Whangbo, M. H.}, year={2012}, pages={6890–6897} } @article{lee_kan_whangbo_bussmann-holder_simon_2012, title={spin/charge redistributions and oxygen atom displacements induced by spin flip and hole doping in the cuo(2) layer of high-temperature superconductors}, volume={25}, DOI={10.1007/s10948-011-1208-3}, number={1}, journal={Journal of Superconductivity and Novel Magnetism}, author={Lee, C. and Kan, E. J. and Whangbo, M. H. and Bussmann-Holder, A. and Simon, A.}, year={2012}, pages={55–59} } @article{tsukamoto_okamoto_matsuhira_whangbo_hiroi_2011, title={A magnetic transition probed by the Ce ion in square-lattice antiferromagnet CeMnAsO}, volume={80}, number={9}, journal={Journal of the Physical Society of Japan}, author={Tsukamoto, Y. and Okamoto, Y. and Matsuhira, K. and Whangbo, M. H. and Hiroi, Z.}, year={2011} } @article{zhao_nellutla_son_vaughn_ye_smith_caignaert_lufaso_pekarek_smirnov_et al._2011, title={Ba 4 KFe 3 O 9 : A Novel Ferrite Containing Discrete 6-Membered Rings of Corner-Sharing FeO 4 Tetrahedra}, volume={50}, url={http://www.scopus.com/inward/record.url?eid=2-s2.0-80053934262&partnerID=MN8TOARS}, DOI={10.1021/ic201374g}, number={20}, journal={Inorg. Chem.}, publisher={American Chemical Society (ACS)}, author={Zhao, Qingbiao and Nellutla, Saritha and Son, Won-Joon and Vaughn, Shae A. and Ye, Longfei and Smith, Mark D. and Caignaert, Vincent and Lufaso, Michael and Pekarek, Thomas M. and Smirnov, Alex I. and et al.}, year={2011}, month={Oct}, pages={10310–10318} } @article{son_manuel_adroja_whangbo_2011, title={Density Functional Analysis of the Magnetic Structure of Li(3)RuO(4): Importance of the Ru-O center dot center dot center dot O-Ru Spin-Exchange Interactions and Substitutional Ru Defects at the Li Sites}, volume={50}, DOI={10.1021/ic201023j}, number={19}, journal={Inorganic Chemistry}, author={Son, W. J. and Manuel, P. and Adroja, D. and Whangbo, M. H.}, year={2011}, pages={9400–9405} } @article{hoch_simon_lee_whangbo_kohler_2011, title={Density functional analysis of the electronic structure of Cs(9)InO(4): Evidence for the presence of a Cs(-) anion}, volume={226}, DOI={10.1524/zkri.2011.1371}, number={7}, journal={Zeitschrift fur Kristallographie}, author={Hoch, C. and Simon, A. and Lee, C. and Whangbo, M. H. and Kohler, J.}, year={2011}, pages={553–556} } @article{zhang_whangbo_2011, title={Density functional analysis of the spin exchange interactions and charge order patterns in the layered magnetic oxides YBaM(2)O(5) (M = Mn, Fe, Co)}, volume={50}, DOI={10.1021/ic200963g}, number={21}, journal={Inorganic Chemistry}, author={Zhang, Y. M. and Whangbo, M. H.}, year={2011}, pages={10643–10647} } @article{zhang_kan_whangbo_2011, title={Density functional investigation of the difference in the magnetic structures of the layered triangular antiferromagnets CuFeO(2) and AgCrO(2)}, volume={23}, DOI={10.1021/cm2011567}, number={18}, journal={Chemistry of Materials}, author={Zhang, Y. M. and Kan, E. and Whangbo, M. H.}, year={2011}, pages={4181–4185} } @article{zhang_kan_xiang_villesuzanne_whangbo_2011, title={Density functional theory analysis of the interplay between jahn-teller instability, uniaxial magnetism, spin arrangement, metal-metal interaction, and spin-orbit coupling in Ca3CoMo6 (M = Co, Rh, Ir)}, volume={50}, DOI={10.1021/ic1022278}, number={5}, journal={Inorganic Chemistry}, author={Zhang, Y. M. and Kan, E. J. and Xiang, H. J. and Villesuzanne, A. and Whangbo, M. H.}, year={2011}, pages={1758–1766} } @article{tong_kraus_kohler_simon_liu_whangbo_2011, title={Dimers of Ag(2+) ions - synthesis and characterization of the Quaternary Silver Fluoride Ag(2)ZnZr(2)F(14) with [Ag(2)F(7)](3-) Units}, volume={637}, DOI={10.1002/zaac.201100129}, number={9}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Tong, J. and Kraus, F. and Kohler, J. and Simon, A. and Liu, J. and Whangbo, M. H.}, year={2011}, pages={1118–1121} } @article{zheng_huang_qin_zhang_dai_whangbo_2011, title={Facile in situ synthesis of visible-light plasmonic photocatalysts M@TiO2 (M = Au, Pt, Ag) and evaluation of their photocatalytic oxidation of benzene to phenol}, volume={21}, number={25}, journal={Journal of Materials Chemistry}, author={Zheng, Z. K. and Huang, B. B. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2011}, pages={9079–9087} } @article{wang_huang_wang_wang_cheng_zheng_qin_zhang_dai_whangbo_2011, title={Facile synthesis of Zn-rich (GaN)(1-x)(ZnO)(x) solid solutions using layered double hydroxides as precursors}, volume={21}, number={12}, journal={Journal of Materials Chemistry}, author={Wang, J. P. and Huang, B. B. and Wang, Z. Y. and Wang, P. and Cheng, H. F. and Zheng, Z. K. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2011}, pages={4562–4567} } @article{xiang_kan_zhang_whangbo_gong_2011, title={General theory for the ferroelectric polarization induced by spin-spiral order}, volume={107}, DOI={10.1103/physrevlett.107.157202}, number={15}, journal={Physical Review Letters}, author={Xiang, H. J. and Kan, E. J. and Zhang, Y. and Whangbo, M. H. and Gong, X. G.}, year={2011} } @article{kan_wu_xiang_yang_whangbo_2011, title={Half-metallic dirac point in B-Edge hydrogenated BN nanoribbons}, volume={115}, DOI={10.1021/jp2015269}, number={35}, journal={Journal of Physical Chemistry. C}, author={Kan, E. J. and Wu, F. and Xiang, H. J. and Yang, J. L. and Whangbo, M. H.}, year={2011}, pages={17252–17254} } @article{zhao_darriet_whangbo_ye_stackhouse_loye_2011, title={Intriguing interconnections among phase transition, magnetic moment, and valence disproportionation in 2h-perovskite related oxides}, volume={133}, DOI={10.1021/ja209198b}, number={51}, journal={Journal of the American Chemical Society}, author={Zhao, Q. B. and Darriet, J. and Whangbo, M. H. and Ye, L. F. and Stackhouse, C. and Loye, H. C.}, year={2011}, pages={20981–20994} } @misc{whangbo_lee_kohler_2011, title={Metal Anions in Metal-Rich Compounds and Polar Intermetallics}, number={26}, journal={European Journal of Inorganic Chemistry}, author={Whangbo, M. H. and Lee, C. and Kohler, J.}, year={2011}, pages={3841–3847} } @article{manuel_adroja_lindgard_hillier_battle_son_whangbo_2011, title={Neutron scattering and mu SR investigations of quasi-one-dimensional magnetism in the spin=3/2 compound Li(3)RuO(4)}, volume={84}, DOI={10.1103/physrevb.84.174430}, number={17}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Manuel, P. and Adroja, D. T. and Lindgard, P. A. and Hillier, A. D. and Battle, P. D. and Son, W. J. and Whangbo, M. H.}, year={2011} } @article{kan_wu_lee_kang_whangbo_2011, title={On the high magnetic-ordering temperature of the 5d magnetic oxide Ca3LiOsO6 crystallizing in a trigonal crystal structure: Density functional analysis}, volume={50}, DOI={10.1021/ic200305a}, number={9}, journal={Inorganic Chemistry}, author={Kan, E. and Wu, F. and Lee, C. H. and Kang, J. H. and Whangbo, M. H.}, year={2011}, pages={4182–4186} } @article{tian_wibowo_loye_whangbo_2011, title={On the magnetic insulating states, spin frustration, and dominant spin exchange of the ordered double-perovskites Sr2CuOsO6 and Sr2NiOsO6: Density functional analysis}, volume={50}, DOI={10.1021/ic200167j}, number={9}, journal={Inorganic Chemistry}, author={Tian, C. and Wibowo, A. C. and Loye, H. C. Z. and Whangbo, M. H.}, year={2011}, pages={4142–4148} } @article{koo_lee_whangbo_mcintyre_kremer_2011, title={On the nature of the spin frustration in the CuO2 ribbon chains of LiCuVO4: Crystal structure determination at 1.6 K, magnetic susceptibility analysis, and density functional evaluation of the spin exchange constants}, volume={50}, DOI={10.1021/ic102518t}, number={8}, journal={Inorganic Chemistry}, author={Koo, H. J. and Lee, C. and Whangbo, M. H. and McIntyre, G. J. and Kremer, R. K.}, year={2011}, pages={3582–3588} } @article{xiang_kan_wei_whangbo_gong_2011, title={Predicting the spin-lattice order of frustrated systems from first principles}, volume={84}, DOI={10.1103/physrevb.84.224429}, number={22}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Xiang, H. J. and Kan, E. J. and Wei, S. H. and Whangbo, M. H. and Gong, X. G.}, year={2011} } @article{musfeldt_liu_li_kang_lee_jena_manson_schlueter_carr_whangbo_2011, title={Pressure-induced local structure distortions in Cu(pyz)F-2(H2O)(2)}, volume={50}, DOI={10.1021/ic2008039}, number={13}, journal={Inorganic Chemistry}, author={Musfeldt, J. L. and Liu, Z. and Li, S. and Kang, J. and Lee, C. and Jena, P. and Manson, J. L. and Schlueter, J. A. and Carr, G. L. and Whangbo, M. H.}, year={2011}, pages={6347–6352} } @article{law_reuvekamp_glaum_lee_kang_whangbo_kremer_2011, title={Quasi-one-dimensional antiferromagnetism and multiferroicity in CuCrO(4)}, volume={84}, DOI={10.1103/physrevb.84.014426}, number={1}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Law, J. M. and Reuvekamp, P. and Glaum, R. and Lee, C. and Kang, J. and Whangbo, M. H. and Kremer, R. K.}, year={2011} } @article{xiang_kan_whangbo_lee_wei_gong_2011, title={Single-ion anisotropy, Dzyaloshinskii-Moriya interaction, and negative magnetoresistance the spin-1/2 pyrochlore R2V2O7}, volume={83}, DOI={10.1103/physrevb.83.174402}, number={17}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Xiang, H. J. and Kan, E. J. and Whangbo, M. H. and Lee, C. and Wei, S. H. and Gong, X. G.}, year={2011} } @article{law_hoch_glaum_heinmaa_stern_kang_lee_whangbo_kremer_2011, title={Spin-Peierls transition in the S=1/2 compound TiPO4 featuring large intrachain coupling}, volume={83}, DOI={10.1103/physrevb.83.180414}, number={18}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Law, J. M. and Hoch, C. and Glaum, R. and Heinmaa, I. and Stern, R. and Kang, J. and Lee, C. and Whangbo, M. H. and Kremer, R. K.}, year={2011} } @article{manson_lapidus_stephens_peterson_carreiro_southerland_lancaster_blundell_steele_goddard_et al._2011, title={Structural, electronic, and magnetic properties of quasi-1D quantum magnets [Ni(HF2)(pyz)(2)]X (pyz = pyrazine; X = PF6-, SbF6-) exhibiting Ni-FHF-Ni and Ni-pyz-Ni spin interactions}, volume={50}, DOI={10.1021/ic102532h}, number={13}, journal={Inorganic Chemistry}, author={Manson, J. L. and Lapidus, S. H. and Stephens, P. W. and Peterson, P. K. and Carreiro, K. E. and Southerland, H. I. and Lancaster, T. and Blundell, S. J. and Steele, A. J. and Goddard, P. A. and et al.}, year={2011}, pages={5990–6009} } @article{tang_li_mallik_zhang_clerac_yee_whangbo_mungalimane_holmes_2011, title={Synthesis and characterization of di- and trivalent pyrazolylborate beta-diketonates and cyanometalates}, volume={50}, DOI={10.1021/ic200464t}, number={11}, journal={Inorganic Chemistry}, author={Tang, M. A. and Li, D. F. and Mallik, U. P. and Zhang, Y. Z. and Clerac, R. and Yee, G. T. and Whangbo, M. H. and Mungalimane, A. and Holmes, S. M.}, year={2011}, pages={5153–5164} } @article{zheng_huang_wei_dai_whangbo_2011, title={Synthesis and optical properties of amorphous C-Si-O particles}, volume={131}, DOI={10.1016/j.jlumin.2010.10.001}, number={2}, journal={Journal of Luminescence}, author={Zheng, L. R. and Huang, B. B. and Wei, J. Y. and Dai, Y. and Whangbo, M. H.}, year={2011}, pages={218–224} } @article{manson_warter_schlueter_lancaster_steele_blundell_pratt_singleton_mcdonald_lee_et al._2011, title={[Cu(HF2)(2)(pyrazine)](n): A rectangular antiferromagnetic lattice with a spin exchange path made up of two different FHF- bridges}, volume={50}, DOI={10.1002/anie.201006653}, number={7}, journal={Angewandte Chemie [International Edition in English]}, author={Manson, J. L. and Warter, M. L. and Schlueter, J. A. and Lancaster, T. and Steele, A. J. and Blundell, S. J. and Pratt, F. L. and Singleton, J. and McDonald, R. D. and Lee, C. and et al.}, year={2011}, pages={1573–1576} } @article{liu_huang_wang_qin_zhang_wei_dai_wang_whangbo_2010, title={Amino acid-assisted synthesis of ZnO twin-prisms and functional group's influence on their morphologies}, volume={507}, DOI={10.1016/j.jallcom.2010.07.192}, number={1}, journal={Journal of Alloys and Compounds}, author={Liu, H. X. and Huang, B. B. and Wang, Z. Y. and Qin, X. Y. and Zhang, X. Y. and Wei, J. Y. and Dai, Y. and Wang, P. and Whangbo, M. H.}, year={2010}, pages={326–330} } @article{tian_lee_kan_wu_whangbo_2010, title={Analysis of the magnetic structure and ferroelectric polarization of monoclinic MnSb2S4 by density functional theory calculations}, volume={49}, DOI={10.1021/ic101351b}, number={23}, journal={Inorganic Chemistry}, author={Tian, C. A. and Lee, C. and Kan, E. J. and Wu, F. and Whangbo, M. H.}, year={2010}, pages={10956–10959} } @article{mentre_kabbour_ehora_tricot_daviero-minaud_whangbo_2010, title={Anion-vacancy-induced magneto-crystalline anisotropy in fluorine-doped hexagonal cobaltites}, volume={132}, DOI={10.1021/ja100170m}, number={13}, journal={Journal of the American Chemical Society}, author={Mentre, O. and Kabbour, H. and Ehora, G. and Tricot, G. and Daviero-Minaud, S. and Whangbo, M. H.}, year={2010}, pages={4865–4875} } @article{tong_lee_whangbo_kremer_simon_kohler_2010, title={Cooperative Jahn-Teller distortion leading to the spin-1/2 uniform antiferromagnetic chains in triclinic perovskites AgCuF3 and NaCuF3}, volume={12}, DOI={10.1016/j.solidstatesciences.2009.02.028}, number={5}, journal={Solid State Sciences}, author={Tong, J. and Lee, C. and Whangbo, M. H. and Kremer, R. K. and Simon, A. and Kohler, J.}, year={2010}, pages={680–684} } @article{law_hoch_whangbo_kremer_2010, title={Description of anhydrous (black) dioptase as a s=1/2 uniform antiferromagnetic chain system}, volume={636}, DOI={10.1002/zaac.200900403}, number={1}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Law, J. M. and Hoch, C. and Whangbo, M. H. and Kremer, R. K.}, year={2010}, pages={54–61} } @article{schlueter_wiehl_park_souza_lang_koo_whangbo_2010, title={Enhanced critical temperature in a dual-layered molecular superconductor}, volume={132}, DOI={10.1021/ja105854m}, number={46}, journal={Journal of the American Chemical Society}, author={Schlueter, J. A. and Wiehl, L. and Park, H. and Souza, M. and Lang, M. and Koo, H. J. and Whangbo, M. H.}, year={2010}, pages={16308–16310} } @article{kan_xiang_wu_lee_yang_whangbo_2010, title={Ferrimagnetism in zigzag graphene nanoribbons induced by main-group adatoms}, volume={96}, number={10}, journal={Applied Physics Letters}, author={Kan, E. and Xiang, H. J. and Wu, F. and Lee, C. and Yang, J. L. and Whangbo, M. H.}, year={2010} } @article{kan_xiang_lee_wu_yang_whangbo_2010, title={Ferroelectricity in perovskites with s(0) A-site cations: Toward near-room-temperature multiferroics}, volume={49}, DOI={10.1002/anie.200905997}, number={9}, journal={Angewandte Chemie [International Edition in English]}, author={Kan, E. and Xiang, H. J. and Lee, C. and Wu, F. and Yang, J. L. and Whangbo, M. H.}, year={2010}, pages={1603–1606} } @article{tassel_kang_lee_hernandez_qiu_paulus_collet_lake_guidi_whangbo_et al._2010, title={Ferromagnetically coupled shastry-sutherland quantum spin singlets in (CuCl)LaNb2O7}, volume={105}, DOI={10.1103/physrevlett.105.167205}, number={16}, journal={Physical Review Letters}, author={Tassel, C. and Kang, J. and Lee, C. and Hernandez, O. and Qiu, Y. and Paulus, W. and Collet, E. and Lake, B. and Guidi, T. and Whangbo, M. H. and et al.}, year={2010} } @article{koo_whangbo_2010, title={Finite magnetization plateau from a two-dimensional antiferromagnet: Density functional analysis of the magnetic structure of Cu-3(P2O6OH)(2)}, volume={49}, DOI={10.1021/ic100906s}, number={20}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2010}, pages={9253–9256} } @article{tang_li_mallik_withers_brauer_rhodes_clerac_yee_whangbo_holmes_2010, title={First structurally characterized tricyanomanganate(III) and its magnetic {(Mn2M2II)-M-III} complexes (M-II = Mn, Ni)}, volume={49}, DOI={10.1021/ic1006605}, number={11}, journal={Inorganic Chemistry}, author={Tang, M. N. and Li, D. F. and Mallik, U. P. and Withers, J. R. and Brauer, S. and Rhodes, M. R. and Clerac, R. and Yee, G. T. and Whangbo, M. H. and Holmes, S. M.}, year={2010}, pages={4753–4755} } @article{dorolti_cario_corraze_janod_vaju_koo_kan_whangbo_2010, title={Half-metallic ferromagnetism and large negative magnetoresistance in the new lacunar spinel GaTi3VS8}, volume={132}, DOI={10.1021/ja908128b}, number={16}, journal={Journal of the American Chemical Society}, author={Dorolti, E. and Cario, L. and Corraze, B. and Janod, E. and Vaju, C. and Koo, H. J. and Kan, E. and Whangbo, M. H.}, year={2010}, pages={5704–5710} } @article{tomiyasu_kageyama_lee_whangbo_tsujimoto_yoshimura_taylor_llobet_trouw_kakurai_et al._2010, title={Magnetic excitations in infinite-layer antiferromagnetic insulator}, volume={79}, number={3}, journal={Journal of the Physical Society of Japan}, author={Tomiyasu, K. and Kageyama, H. and Lee, C. and Whangbo, M. H. and Tsujimoto, Y. and Yoshimura, K. and Taylor, J. W. and Llobet, A. and Trouw, F. and Kakurai, K. and et al.}, year={2010} } @article{white_lee_gunaydin-sen_tung_christen_wang_turnbull_landee_mcdonald_crooker_et al._2010, title={Magneto-optical properties and charge-spin coupling in the molecular (2,3-dmpyH)(2)CuBr4 spin-ladder material}, volume={81}, DOI={10.1103/physrevb.81.052407}, number={5}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={White, J. L. and Lee, C. and Gunaydin-Sen, O. and Tung, L. C. and Christen, H. M. and Wang, Y. J. and Turnbull, M. M. and Landee, C. P. and McDonald, R. D. and Crooker, S. A. and et al.}, year={2010} } @article{ji_kan_whangbo_kim_qiu_matsuda_yoshida_hiroi_green_ziman_et al._2010, title={Orbital order and partial electronic delocalization in a triangular magnetic metal Ag2MnO2}, volume={81}, DOI={10.1103/physrevb.81.094421}, number={9}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Ji, S. and Kan, E. J. and Whangbo, M. H. and Kim, J. H. and Qiu, Y. and Matsuda, M. and Yoshida, H. and Hiroi, Z. and Green, M. A. and Ziman, T. and et al.}, year={2010} } @article{tian_kan_lee_whangbo_2010, title={Pi-back-donation effect of the cyanide ligands on the electron correlation and charge transfer in Prussian blue RbMn[Fe(CN)(6)]}, volume={49}, DOI={10.1021/ic902577r}, number={7}, journal={Inorganic Chemistry}, author={Tian, C. and Kan, E. and Lee, C. and Whangbo, M. H.}, year={2010}, pages={3086–3088} } @article{kan_xiang_wu_tian_lee_yang_whangbo_2010, title={Prediction for room-temperature half-metallic ferromagnetism in the half-fluorinated single layers of BN and ZnO}, volume={97}, number={12}, journal={Applied Physics Letters}, author={Kan, E. J. and Xiang, H. J. and Wu, F. and Tian, C. and Lee, C. and Yang, J. L. and Whangbo, M. H.}, year={2010} } @article{zhang_dai_huang_whangbo_2010, title={Quantum confinement effect on the vacancy-induced spin polarization in carbon, silicon, and germanium nanoparticles: Density functional analysis}, volume={96}, number={6}, journal={Applied Physics Letters}, author={Zhang, Z. K. and Dai, Y. and Huang, B. B. and Whangbo, M. H.}, year={2010} } @article{rocquefelte_whangbo_villesuzanne_jobic_tran_schwarz_blaha_2010, title={Short-range magnetic order and temperature-dependent properties of cupric oxide}, volume={22}, number={4}, journal={Journal of Physics. Condensed Matter}, author={Rocquefelte, X. and Whangbo, M. H. and Villesuzanne, A. and Jobic, S. and Tran, F. and Schwarz, K. and Blaha, P.}, year={2010} } @article{koo_whangbo_2010, title={Spin dimer and mapping analyses of the magnetic properties of VO(CH3CO2)(2) and VO(OCH2CH2O)}, volume={12}, DOI={10.1016/j.solidstatesciences.2009.03.023}, number={5}, journal={Solid State Sciences}, author={Koo, H. J. and Whangbo, M. H.}, year={2010}, pages={685–690} } @article{manson_lancaster_blundell_qiu_singleton_sengupta_pratt_kang_lee_whangbo_2010, title={Spin fluctuations and orbital ordering in quasi-one-dimensional alpha-Cu(dca)(2)(pyz) {dca = dicyanamide = N(CN)(2)(-); pyz = pyrazine}, a molecular analogue of KCuF3}, volume={29}, DOI={10.1016/j.poly.2009.06.063}, number={1}, journal={Polyhedron}, author={Manson, J. L. and Lancaster, T. and Blundell, S. J. and Qiu, Y. M. and Singleton, J. and Sengupta, P. and Pratt, F. L. and Kang, J. and Lee, C. and Whangbo, M. H.}, year={2010}, pages={514–520} } @article{gunaydin-sen_lee_tung_chen_turnbull_landee_wang_whangbo_musfeldt_2010, title={Spin-lattice interactions through the quantum critical transition in Cu(pyz)(NO3)(2)}, volume={81}, DOI={10.1103/physrevb.81.104307}, number={10}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Gunaydin-Sen, O. and Lee, C. and Tung, L. C. and Chen, P. and Turnbull, M. M. and Landee, C. P. and Wang, Y. J. and Whangbo, M. H. and Musfeldt, J. L.}, year={2010} } @article{ben yahia_gaudin_boulahya_darriet_son_whangbo_2010, title={Synthesis and characterization of the crystal structure and magnetic properties of the ternary manganese vanadate NaMnVO4}, volume={49}, DOI={10.1021/ic101180h}, number={18}, journal={Inorganic Chemistry}, author={Ben Yahia, H. and Gaudin, E. and Boulahya, K. and Darriet, J. and Son, W. J. and Whangbo, M. H.}, year={2010}, pages={8578–8582} } @article{wang_huang_wang_qin_zhang_dai_whangbo_2010, title={Synthesis of anatase TiO2 tubular structures microcrystallites with a high percentage of {001} facets by a simple one-step hydrothermal template process}, volume={16}, DOI={10.1002/chem.200903503}, number={24}, journal={Chemistry (Weinheim An Der Bergstrasse, Germany)}, author={Wang, X. N. and Huang, B. B. and Wang, Z. Y. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2010}, pages={7106–7109} } @inproceedings{tong_kremer_kohler_simon_lee_kan_whangbo_2010, title={The layered ferromagnet Cs2AgF4: Antiferromagnetic inter-layer coupling driven by magnetic dipole-dipole interactions}, volume={225}, number={11}, booktitle={Zeitschrift fur Kristallographie}, author={Tong, J. W. and Kremer, R. K. and Kohler, J. and Simon, A. and Lee, C. H. and Kan, E. and Whangbo, M. H.}, year={2010}, pages={498–503} } @article{wu_kan_tian_whangbo_2010, title={Theoretical analysis of the spin exchange and magnetic dipole-dipole interactions leading to the magnetic structure of Ni3TeO6}, volume={49}, DOI={10.1021/ic101022f}, number={16}, journal={Inorganic Chemistry}, author={Wu, F. and Kan, E. and Tian, C. A. and Whangbo, M. H.}, year={2010}, pages={7545–7548} } @article{lee_kan_xiang_whangbo_2010, title={Theoretical investigation of the magnetic structure and ferroelectric polarization of the multiferroic langasite Ba3NbFe3Si2O14}, volume={22}, DOI={10.1021/cm101441p}, number={18}, journal={Chemistry of Materials}, author={Lee, C. and Kan, E. J. and Xiang, H. J. and Whangbo, M. H.}, year={2010}, pages={5290–5295} } @article{xiang_kan_wei_gong_whangbo_2010, title={Thermodynamically stable single-side hydrogenated graphene}, volume={82}, DOI={10.1103/physrevb.82.165425}, number={16}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Xiang, H. J. and Kan, E. J. and Wei, S. H. and Gong, X. G. and Whangbo, M. H.}, year={2010} } @article{lee_whangbo_kohler_2010, title={analysis of electronic structures and chemical bonding of metal-rich compounds. 2. Presence of dimer (T-T)(4-) and isolated T2- anions in the polar intermetallic Cr5B3-type compounds AE(5)T(3) (AE = Ca, Sr; T = Au, Ag, Hg, Cd, Zn)}, volume={636}, DOI={10.1002/zaac.200900421}, number={1}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Lee, C. and Whangbo, M. H. and Kohler, J.}, year={2010}, pages={36–40} } @article{wu_kan_whangbo_2010, title={k On the importance of the interplaquette spin exchanges in Na3RuO4: Density functional theory analysis of the spin exchange and magnetic properties}, volume={49}, DOI={10.1021/ic902568v}, number={6}, journal={Inorganic Chemistry}, author={Wu, F. and Kan, E. J. and Whangbo, M. H.}, year={2010}, pages={3025–3028} } @article{xiang_kan_wei_whangbo_yang_2009, title={"Narrow" graphene nanoribbons made easier by partial hydrogenation}, volume={9}, DOI={10.1021/nl902198u}, number={12}, journal={Nano Letters}, author={Xiang, H. J. and Kan, E. J. and Wei, S. H. and Whangbo, M. H. and Yang, J. L.}, year={2009}, pages={4025–4030} } @article{whangbo_kohler_2009, title={A striking transition}, volume={1}, DOI={10.1038/nchem.308}, number={5}, journal={Nature Chemistry}, author={Whangbo, M. H. and Kohler, J.}, year={2009}, pages={351–352} } @article{wang_huang_qin_zhang_dai_whangbo_2009, title={Ag/AgBr/WO3 center dot H2O: Visible-Light Photocatalyst for Bacteria Destruction}, volume={48}, DOI={10.1021/ic9014652}, number={22}, journal={Inorganic Chemistry}, author={Wang, P. and Huang, B. B. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Whangbo, M. H.}, year={2009}, pages={10697–10702} } @article{manson_stone_southerland_lancaster_steele_blundell_pratt_baker_mcdonald_sengupta_et al._2009, title={Characterization of the antiferromagnetism in Ag(pyz)(2)(S2O8) (pyz = Pyrazine) with a two-dimensional square lattice of Ag2+ ions}, volume={131}, DOI={10.1021/ja9005223}, number={13}, journal={Journal of the American Chemical Society}, author={Manson, J. L. and Stone, K. H. and Southerland, H. I. and Lancaster, T. and Steele, A. J. and Blundell, S. J. and Pratt, F. L. and Baker, P. J. and McDonald, R. D. and Sengupta, P. and et al.}, year={2009}, pages={4590-} } @article{brinzari_tian_halder_musfeldt_whangbo_schlueter_2009, title={Color properties and structural phase transition in penta- and hexacoordinate isothiocyanato Ni(II) compounds}, volume={48}, DOI={10.1021/ic802120n}, number={16}, journal={Inorganic Chemistry}, author={Brinzari, T. V. and Tian, C. and Halder, G. J. and Musfeldt, J. L. and Whangbo, M. H. and Schlueter, J. A.}, year={2009}, pages={7650–7658} } @article{reiff_schulz_whangbo_seo_lee_potratz_spicer_girolami_2009, title={Consequences of a linear two-coordinate geometry for the orbital magnetism and Jahn-Teller distortion behavior of the high spin iron(II) complex Fe[N(t-Bu)(2)](2)}, volume={131}, DOI={10.1021/ja806660f}, number={2}, journal={Journal of the American Chemical Society}, author={Reiff, W. M. and Schulz, C. E. and Whangbo, M. H. and Seo, J. I. and Lee, Y. S. and Potratz, G. R. and Spicer, C. W. and Girolami, G. S.}, year={2009}, pages={404-} } @article{kang_lee_kremer_whangbo_2009, title={Consequences of the intrachain dimer-monomer spin frustration and the interchain dimer-monomer spin exchange in the diamond-chain compound azurite Cu-3(CO3)(2)(OH)(2)}, volume={21}, number={39}, journal={Journal of Physics. Condensed Matter}, author={Kang, J. and Lee, C. and Kremer, R. K. and Whangbo, M. H.}, year={2009} } @article{yang_dai_huang_whangbo_2009, title={Density functional characterization of the visible-light absorption in substitutional C-Anion- and C-Cation-doped TiO2}, volume={113}, DOI={10.1021/jp808483a}, number={6}, journal={Journal of Physical Chemistry. C}, author={Yang, K. S. and Dai, Y. and Huang, B. B. and Whangbo, M. H.}, year={2009}, pages={2624–2629} } @article{lee_kang_lee_whangbo_2009, title={Density functional investigation of the antiferromagnetic ordering, spin orientation, and ferroelectric polarization of rare-earth iron borate TbFe3(BO3)(4)}, volume={21}, DOI={10.1021/cm9006475}, number={12}, journal={Chemistry of Materials}, author={Lee, C. and Kang, J. and Lee, K. H. and Whangbo, M. H.}, year={2009}, pages={2534–2539} } @article{koo_whangbo_2009, title={Density functional investigation of the magnetic properties of PbMBO4 (M = Cr, Mn, Fe)}, volume={149}, DOI={10.1016/j.ssc.2009.01.030}, number={15-16}, journal={Solid State Communications}, author={Koo, H. J. and Whangbo, M. H.}, year={2009}, pages={602–604} } @article{yang_dai_huang_whangbo_2009, title={Density functional studies of the magnetic properties in nitrogen doped TiO2}, volume={481}, DOI={10.1016/j.cplett.2009.09.050}, number={1-3}, journal={Chemical Physics Letters}, author={Yang, K. S. and Dai, Y. and Huang, B. B. and Whangbo, M. H.}, year={2009}, pages={99–102} } @article{kan_xiang_zhang_lee_whangbo_2009, title={Density-functional analysis of spin exchange and ferroelectric polarization in AgCrO2}, volume={80}, DOI={10.1103/physrevb.80.104417}, number={10}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Kan, E. J. and Xiang, H. J. and Zhang, Y. and Lee, C. and Whangbo, M. H.}, year={2009} } @article{koo_xiang_lee_whangbo_2009, title={Effect of magnetic dipole-dipole interactions on the spin orientation and magnetic ordering of the spin-ladder compound Sr3Fe2O5}, volume={48}, DOI={10.1021/ic9007526}, number={19}, journal={Inorganic Chemistry}, author={Koo, H. J. and Xiang, H. J. and Lee, C. and Whangbo, M. H.}, year={2009}, pages={9051–9053} } @article{meddar_josse_deniard_la_andre_damay_petricek_jobic_whangbo_maglione_et al._2009, title={Effect of nonmagnetic substituents Mg and Zn on the phase competition in the multiferroic antiferromagnet MnWO4}, volume={21}, DOI={10.1021/cm9021358}, number={21}, journal={Chemistry of Materials}, author={Meddar, L. and Josse, M. and Deniard, P. and La, C. and Andre, G. and Damay, F. and Petricek, V. and Jobic, S. and Whangbo, M. H. and Maglione, M. and et al.}, year={2009}, pages={5203–5214} } @article{jin_dai_huang_whangbo_2009, title={Ferromagnetism of undoped GaN mediated by through-bond spin polarization between nitrogen dangling bonds}, volume={94}, number={16}, journal={Applied Physics Letters}, author={Jin, H. and Dai, Y. and Huang, B. B. and Whangbo, M. H.}, year={2009} } @article{zheng_huang_qin_zhang_dai_jiang_wang_whangbo_2009, title={Highly efficient photocatalyst: TiO2 microspheres produced from TiO2 nanosheets with a high percentage of reactive {001} facets}, volume={15}, DOI={10.1002/chem.200902438}, number={46}, journal={Chemistry (Weinheim An Der Bergstrasse, Germany)}, author={Zheng, Z. K. and Huang, B. B. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Jiang, M. H. and Wang, P. and Whangbo, M. H.}, year={2009}, pages={12576–12579} } @article{wang_huang_zhang_qin_jin_dai_wang_wei_zhan_wang_et al._2009, title={Highly efficient visible-light plasmonic photocatalyst Ag@AgBr}, volume={15}, DOI={10.1002/chem.200802327}, number={8}, journal={Chemistry (Weinheim An Der Bergstrasse, Germany)}, author={Wang, P. and Huang, B. B. and Zhang, X. Y. and Qin, X. Y. and Jin, H. and Dai, Y. and Wang, Z. Y. and Wei, J. Y. and Zhan, J. and Wang, S. Y. and et al.}, year={2009}, pages={1821–1824} } @article{mentre_janod_rabu_hennion_leclercq-hugeux_kang_lee_whangbo_petit_2009, title={Incommensurate spin correlation driven by frustration in BiCu2PO6}, volume={80}, DOI={10.1103/physrevb.80.180413}, number={18}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Mentre, O. and Janod, E. and Rabu, P. and Hennion, M. and Leclercq-Hugeux, F. and Kang, J. and Lee, C. and Whangbo, M. H. and Petit, S.}, year={2009} } @article{zhang_xiang_whangbo_2009, title={Interplay between Jahn-Teller instability, uniaxial magnetism, and ferroelectricity in Ca3CoMnO6}, volume={79}, DOI={10.1103/physrevb.79.054432}, number={5}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Zhang, Y. and Xiang, H. J. and Whangbo, M. H.}, year={2009} } @article{dessapt_collet_coue_bujoli-doeuff_jobic_lee_whangbo_2009, title={Kinetics of coloration in photochromic organoammonium polyoxomolybdates}, volume={48}, DOI={10.1021/ic8013865}, number={2}, journal={Inorganic Chemistry}, author={Dessapt, R. and Collet, M. and Coue, V. and Bujoli-Doeuff, M. and Jobic, S. and Lee, C. and Whangbo, M. H.}, year={2009}, pages={574–580} } @article{kohler_simon_whangbo_2009, title={Magnetic Interactions of the 15-Electron Nb6F12 Clusters in Nb6F15}, volume={635}, DOI={10.1002/zaac.200900496}, number={15}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Kohler, J. and Simon, A. and Whangbo, M. H.}, year={2009}, pages={2396–2398} } @article{banks_kremer_hoch_simon_ouladdiaf_broto_rakoto_lee_whangbo_2009, title={Magnetic ordering in the frustrated Heisenberg chain system cupric chloride CuCl2}, volume={80}, DOI={10.1103/physrevb.80.024404}, number={2}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Banks, M. G. and Kremer, R. K. and Hoch, C. and Simon, A. and Ouladdiaf, B. and Broto, J. M. and Rakoto, H. and Lee, C. and Whangbo, M. H.}, year={2009} } @article{wu_kan_xiang_wei_whangbo_yang_2009, title={Magnetic states of zigzag graphene nanoribbons from first principles}, volume={94}, number={22}, journal={Applied Physics Letters}, author={Wu, F. and Kan, E. J. and Xiang, H. J. and Wei, S. H. and Whangbo, M. H. and Yang, J. L.}, year={2009} } @article{tian_lee_xiang_zhang_payen_jobic_whangbo_2009, title={Magnetic structure and ferroelectric polarization of MnWO4 investigated by density functional calculations and classical spin analysis}, volume={80}, DOI={10.1103/physrevb.80.104426}, number={10}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Tian, C. and Lee, C. H. and Xiang, H. J. and Zhang, Y. M. and Payen, C. and Jobic, S. and Whangbo, M. H.}, year={2009} } @article{kan_xiang_yang_whangbo_2009, title={Magnetism of semiconductor-based magnetic tunnel junctions under electric field from first principles}, volume={94}, number={25}, journal={Applied Physics Letters}, author={Kan, E. J. and Xiang, H. J. and Yang, J. L. and Whangbo, M. H.}, year={2009} } @article{musfeldt_vergara_brinzari_lee_tung_kang_wang_schlueter_manson_whangbo_2009, title={Magnetoelastic coupling through the antiferromagnet-to-ferromagnet transition of quasi-two-dimensional [Cu(HF2)(pyz)(2)]BF4 using infrared spectroscopy}, volume={103}, DOI={10.1103/physrevlett.103.157401}, number={15}, journal={Physical Review Letters}, author={Musfeldt, J. L. and Vergara, L. I. and Brinzari, T. V. and Lee, C. and Tung, L. C. and Kang, J. and Wang, Y. J. and Schlueter, J. A. and Manson, J. L. and Whangbo, M. H.}, year={2009} } @article{xiang_kan_wei_whangbo_yang_2009, title={Origin of the Ising ferrimagnetism and spin-charge coupling in LuFe2O4}, volume={80}, DOI={10.1103/physrevb.80.132408}, number={13}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Xiang, H. J. and Kan, E. J. and Wei, S. H. and Whangbo, M. H. and Yang, J. L.}, year={2009} } @article{liu_huang_dai_zhang_qin_jiang_whangbo_2009, title={Selective ethanol formation from photocatalytic reduction of carbon dioxide in water with BiVO4 photocatalyst}, volume={11}, DOI={10.1016/j.catcom.2009.10.010}, number={3}, journal={Catalysis Communications}, author={Liu, Y. Y. and Huang, B. B. and Dai, Y. and Zhang, X. Y. and Qin, X. Y. and Jiang, M. H. and Whangbo, M. H.}, year={2009}, pages={210–213} } @article{denis_rocquefelte_deniard_whangbo_jobic_2009, title={Site preference of Eu2+ dopants in the (Ba,Sr)(13-x)Al22-2xSi10+2xO66 phosphor and its effect on the luminescence properties: A density functional investigation}, volume={19}, DOI={10.1039/b914374b}, number={48}, journal={Journal of Materials Chemistry}, author={Denis, G. and Rocquefelte, X. and Deniard, P. and Whangbo, M. H. and Jobic, S.}, year={2009}, pages={9170–9175} } @article{manson_schlueter_funk_southerland_twamley_lancaster_blundell_baker_pratt_singleton_et al._2009, title={Strong H center dot center dot center dot F hydrogen bonds as synthons in polymeric quantum magnets: Structural, magnetic, and theoretical characterization of [Cu(HF2)(pyrazine)(2)]SbF6, [Cu2F(HF)(HF2)(pyrazine)(4)](SbF6)(2), and [CuAg(H3F4)(pyrazine)(5)]}, volume={131}, DOI={10.1021/ja808761d}, number={19}, journal={Journal of the American Chemical Society}, author={Manson, J. L. and Schlueter, J. A. and Funk, K. A. and Southerland, H. I. and Twamley, B. and Lancaster, T. and Blundell, S. J. and Baker, P. J. and Pratt, F. L. and Singleton, J. and et al.}, year={2009}, pages={6733–6747} } @article{lee_kang_lee_whangbo_2009, title={Symmetry-dependent strong reduction of the spin exchange interactions in Cs2CuCl4 by the 6p orbitals of Cs+ Ions}, volume={48}, DOI={10.1021/ic802412x}, number={9}, journal={Inorganic Chemistry}, author={Lee, C. and Kang, J. and Lee, K. H. and Whangbo, M. H.}, year={2009}, pages={4165–4170} } @article{he_whangbo_ueda_narumi_kindo_taniyama_itoh_cheng_2009, title={Synthesis and magnetic properties of Ba2Mn2Si2O9: the first example of S=2 spin-dimer with spin-singlet ground}, volume={4}, DOI={10.1002/asia.200900235}, number={10}, journal={Chemistry, An Asian Journal}, author={He, Z. Z. and Whangbo, M. H. and Ueda, Y. and Narumi, Y. and Kindo, K. and Taniyama, T. and Itoh, M. and Cheng, W. D.}, year={2009}, pages={1530–1535} } @article{wang_huang_qin_zhang_dai_wei_whangbo_2008, title={Ag@AgCl: A highly efficient and stable photocatalyst active under visible light}, volume={47}, DOI={10.1002/anie.200802483}, number={41}, journal={Angewandte Chemie [International Edition in English]}, author={Wang, P. and Huang, B. B. and Qin, X. Y. and Zhang, X. Y. and Dai, Y. and Wei, J. Y. and Whangbo, M. H.}, year={2008}, pages={7931–7933} } @article{lee_whangbo_kohler_2008, title={Analysis of electronic structures and chemical bonding of metal-rich compounds. I. Density functional study of Pt metal, LiPt2, LiPt, and Li2Pt}, volume={29}, DOI={10.1002/jcc.21020}, number={13}, journal={Journal of Computational Chemistry}, author={Lee, C. H. and Whangbo, M. H. and Kohler, J.}, year={2008}, pages={2154–2160} } @article{koo_whangbo_2008, title={Analysis of the spin lattice model for the spin-gapped layered compounds Na3Cu2SbO6 and Na2Cu2TeO6 on the basis of electronic structure calculations}, volume={47}, DOI={10.1021/ic701153z}, number={1}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2008}, pages={128–133} } @article{liu_dronskowski_kremer_ahrens_lee_whangbo_2008, title={Characterization of the magnetic and structural properties of copper carbodiimide, CuNCN, by neutron diffraction and first-principles evaluations of its spin exchange interactions}, volume={112}, DOI={10.1021/jp8007199}, number={29}, journal={Journal of Physical Chemistry. C}, author={Liu, X. X. and Dronskowski, R. and Kremer, R. K. and Ahrens, M. and Lee, C. H. and Whangbo, M. H.}, year={2008}, pages={11013–11017} } @article{angst_hermann_christianson_lumsden_lee_whangbo_kim_ryan_nagler_tian_et al._2008, title={Charge order in LuFe2O4: Antiferroelectric ground state and coupling to magnetism}, volume={101}, DOI={10.1103/physrevlett.101.227601}, number={22}, journal={Physical Review Letters}, author={Angst, M. and Hermann, R. P. and Christianson, A. D. and Lumsden, M. D. and Lee, C. and Whangbo, M. H. and Kim, J. W. and Ryan, P. J. and Nagler, S. E. and Tian, W. and et al.}, year={2008} } @article{wang_huang_zhang_qin_dai_jin_wei_whangbo_2008, title={Composite semiconductor H2WO4 center dot H2O/AgCl as an efficient and stable photocatalyst under visible light}, volume={14}, number={34}, journal={Chemistry (Weinheim An Der Bergstrasse, Germany)}, author={Wang, P. and Huang, B. B. and Zhang, X. Y. and Qin, X. Y. and Dai, Y. and Jin, H. and Wei, J. Y. and Whangbo, M. H.}, year={2008}, pages={10543–10546} } @article{yang_dai_huang_whangbo_2008, title={Density functional characterization of the band edges, the band gap states, and the preferred doping sites of Halogen-doped TiO2}, volume={20}, DOI={10.1021/cm801741m}, number={20}, journal={Chemistry of Materials}, author={Yang, K. S. and Dai, Y. and Huang, B. B. and Whangbo, M. H.}, year={2008}, pages={6528–6534} } @article{koo_whangbo_2008, title={Determination of the spin-lattice relevant for the quaternary magnetic oxide Bi4Cu3V2O14 on the basis of tight-binding and density functional calculations}, volume={47}, DOI={10.1021/ic800216j}, number={11}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2008}, pages={4779–4784} } @article{dai_xiang_whangbo_2008, title={Effects of spin-orbit coupling on magnetic properties of discrete and extended magnetic systems}, volume={29}, DOI={10.1002/jcc.21011}, number={13}, journal={Journal of Computational Chemistry}, author={Dai, D. and Xiang, H. J. and Whangbo, M. H.}, year={2008}, pages={2187–2209} } @article{kohler_whangbo_2008, title={Electronic structure study of the [Ag-Ag](4-), [Au-Au](4-), and [Hg-Hg](2-) zintl anions in the intermetallic compounds Yb3Ag2, Ca5Au4, and Ca3Hg2: Transition metal anions as p-metal elements}, volume={20}, DOI={10.1021/cm703590d}, number={8}, journal={Chemistry of Materials}, author={Kohler, J. and Whangbo, M. H.}, year={2008}, pages={2751–2756} } @article{wang_huang_yu_dai_wang_qin_zhang_wei_zhan_jing_et al._2008, title={Enhanced ferromagnetism and tunable saturation magnetization of Mn/C-codoped GaN nanostructures synthesized by carbothermal nitridation}, volume={130}, DOI={10.1021/ja807030v}, number={48}, journal={Journal of the American Chemical Society}, author={Wang, Z. Y. and Huang, B. B. and Yu, L. and Dai, Y. and Wang, P. and Qin, X. Y. and Zhang, X. Y. and Wei, J. Y. and Zhan, J. and Jing, X. Y. and et al.}, year={2008}, pages={16366–16373} } @article{manson_conner_schlueter_mcconnell_southerland_malfant_lancaster_blundell_brooks_pratt_et al._2008, title={Experimental and theoretical characterization of the magnetic properties of CuF2(H2O)(2)(pyz) (pyz = pyrazine): A two-dimensional quantum magnet arising from supersuperexchange interactions through hydrogen bonded paths}, volume={20}, DOI={10.1021/cm8016566}, number={24}, journal={Chemistry of Materials}, author={Manson, J. L. and Conner, M. M. and Schlueter, J. A. and McConnell, A. C. and Southerland, H. I. and Malfant, I. and Lancaster, T. and Blundell, S. J. and Brooks, M. L. and Pratt, F. L. and et al.}, year={2008}, pages={7408–7416} } @article{suh_park_kang_hwang_jung_kim_lee_whangbo_2008, title={Investigation of the scanning tunneling microscopy image, the stacking pattern and the bias-voltage dependent structural imstability of 2,2'-bipyridine molecules adsorbed on Au(111) in terms of electronic structure calculations}, volume={29}, number={2}, journal={Bulletin of the Korean Chemical Society}, author={Suh, Y. and Park, S. S. and Kang, J. and Hwang, Y. G. and Jung, D. and Kim, D. H. and Lee, K. H. and Whangbo, M. H.}, year={2008}, pages={438–444} } @article{mentre_koo_whangbo_2008, title={Investigation of the vanadyl bond ordering and analysis of the spin exchange interactions in Pb2V3O9 and Pb(2)AS(2)VO(9)}, volume={20}, DOI={10.1021/cm800924j}, number={22}, journal={Chemistry of Materials}, author={Mentre, O. and Koo, H. J. and Whangbo, M. H.}, year={2008}, pages={6929–6938} } @article{kohler_whangbo_2008, title={Late transition metal anions acting as p-metal elements}, volume={10}, DOI={10.1016/j.solidstatesciences.2007.12.001}, number={4}, journal={Solid State Sciences}, author={Kohler, J. and Whangbo, M. H.}, year={2008}, pages={444–449} } @article{chan_lee_dai_whangbo_ibers_2008, title={On the anisotropy of the magnetic properties of CsYbZnSe3}, volume={47}, DOI={10.1021/ic701961f}, number={5}, journal={Inorganic Chemistry}, author={Chan, G. H. and Lee, C. and Dai, D. and Whangbo, M. H. and Ibers, J. A.}, year={2008}, pages={1687–1692} } @article{koo_whangbo_2008, title={On the correct spin lattice for the spin-gapped magnetic solid NH4CuPO4 center dot H2O}, volume={181}, DOI={10.1016/j.jssc.2007.11.033}, number={2}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2008}, pages={276–281} } @article{thiry_gaudon_payen_daro_letard_gorsse_deniard_rocquefelte_demourgues_whangbo_et al._2008, title={On the cyclability of the thermochromism in CuMoO4 and its tungsten derivatives CuMo1-xWxO4 (x < 0.12)}, volume={20}, DOI={10.1021/cm703600g}, number={6}, journal={Chemistry of Materials}, author={Thiry, A. E. and Gaudon, M. and Payen, C. and Daro, N. and Letard, J. F. and Gorsse, S. and Deniard, P. and Rocquefelte, X. and Demourgues, A. and Whangbo, M. H. and et al.}, year={2008}, pages={2075–2077} } @article{yang_dai_huang_whangbo_2008, title={On the possibility of ferromagnetism in carbon-doped anatase TiO2}, volume={93}, number={13}, journal={Applied Physics Letters}, author={Yang, K. S. and Dai, Y. and Huang, B. B. and Whangbo, M. H.}, year={2008} } @article{xiang_wei_whangbo_2008, title={Origin of the structural and magnetic anomalies of the layered compound SrFeO2: A density functional investigation}, volume={100}, DOI={10.1103/physrevlett.100.167207}, number={16}, journal={Physical Review Letters}, author={Xiang, H. J. and Wei, S. H. and Whangbo, M. H.}, year={2008} } @article{xiang_wei_whangbo_da silva_2008, title={Spin-orbit coupling and ion displacements in multiferroic TbMnO3}, volume={101}, DOI={10.1103/physrevlett.101.037209}, number={3}, journal={Physical Review Letters}, author={Xiang, H. J. and Wei, S. H. and Whangbo, M. H. and Da Silva, J. L. F.}, year={2008} } @article{kabbour_janod_corraze_danot_lee_whangbo_cario_2008, title={Structure and magnetic properties of oxychalcogenides A(2)F(2)Fe(2)OQ(2) (A = sr, ba; Q = s, se) with Fe2O square planar layers representing an antiferromagnetic checkerboard spin lattice}, volume={130}, DOI={10.1021/ja711139g}, number={26}, journal={Journal of the American Chemical Society}, author={Kabbour, H. and Janod, E. and Corraze, B. and Danot, M. and Lee, C. and Whangbo, M. H. and Cario, L.}, year={2008}, pages={8261–8270} } @article{xiang_lee_whangbo_2007, title={Absence of a spiral magnetic order in Li2CuO2 containing one-dimensional CuO2 ribbon chains}, volume={76}, DOI={10.1103/physrevb.76.220411}, number={22}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Xiang, H. J. and Lee, C. and Whangbo, M. H.}, year={2007} } @article{manson_lancaster_schlueter_blundell_brooks_pratt_nygren_koo_dai_whangbo_2007, title={Characterization of the crystal and magnetic structures of the mixed-anion coordination polymer Cu(HCO2)(NO3)(pyz) {pyz = pyrazine} by X-ray diffraction, ac magnetic susceptibility, dc magnetization, muon-spin relaxation, and spin dimer analysis}, volume={46}, DOI={10.1021/ic061590q}, number={1}, journal={Inorganic Chemistry}, author={Manson, J. L. and Lancaster, T. and Schlueter, J. A. and Blundell, S. J. and Brooks, M. L. and Pratt, F. L. and Nygren, C. L. and Koo, H. J. and Dai, D. and Whangbo, M. H.}, year={2007}, pages={213–220} } @article{xiang_whangbo_2007, title={Charge order and the origin of giant magnetocapacitance in LuFe2O4}, volume={98}, DOI={10.1103/physrevlett.98.246403}, number={24}, journal={Physical Review Letters}, author={Xiang, H. J. and Whangbo, M. H.}, year={2007} } @article{angst_khalifah_hermann_xiang_whangbo_varadarajan_brill_sales_mandrus_2007, title={Charge order superstructure with integer iron valence in Fe2OBO3}, volume={99}, DOI={10.1103/physrevlett.99.086403}, number={8}, journal={Physical Review Letters}, author={Angst, M. and Khalifah, P. and Hermann, R. P. and Xiang, H. J. and Whangbo, M. H. and Varadarajan, V. and Brill, J. W. and Sales, B. C. and Mandrus, D.}, year={2007} } @article{rocquefelte_jobic_whangbo_2007, title={Concept of optical channel as a guide for tuning the optical properties of insulating materials}, volume={9}, DOI={10.1016/j.solidstatesciences.2007.04.008}, number={7}, journal={Solid State Sciences}, author={Rocquefelte, X. and Jobic, S. and Whangbo, M. H.}, year={2007}, pages={600–603} } @article{xiang_whangbo_2007, title={Cooperative effect of electron correlation and spin-orbit coupling on the electronic and magnetic properties of Ba2NaOsO6}, volume={75}, DOI={10.1103/physrevb.75.052407}, number={5}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Xiang, H. J. and Whangbo, M. H.}, year={2007} } @article{xiang_whangbo_2007, title={Density-functional characterization of the multiferroicity in spin spiral chain cuprates}, volume={99}, DOI={10.1103/physrevlett.99.257203}, number={25}, journal={Physical Review Letters}, author={Xiang, H. J. and Whangbo, M. H.}, year={2007} } @article{matar_subramanian_villesuzanne_eyert_whangbo_2007, title={First principles investigation of the electronic structure of La2MnNiO6: An insulating ferromagnet}, volume={308}, DOI={10.1016/j.jmmm.2006.05.029}, number={1}, journal={Journal of Magnetism and Magnetic Materials}, author={Matar, S. F. and Subramanian, M. A. and Villesuzanne, A. and Eyert, V. and Whangbo, M. H.}, year={2007}, pages={116–119} } @article{matar_eyert_villesuzanne_whangbo_2007, title={First-principles study of the electronic and magnetic structures of the tetragonal and orthorhombic phases of Ca3Mn2O7}, volume={76}, DOI={10.1103/physrevb.76.054403}, number={5}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Matar, S. F. and Eyert, V. and Villesuzanne, A. and Whangbo, M. H.}, year={2007} } @article{angst_hermann_schweika_kim_khalifah_xiang_whangbo_kim_sales_mandrus_2007, title={Incommensurate charge order phase in Fe2OBO3 due to geometrical frustration}, volume={99}, DOI={10.1103/physrevlett.99.256402}, number={25}, journal={Physical Review Letters}, author={Angst, M. and Hermann, R. P. and Schweika, W. and Kim, J. W. and Khalifah, P. and Xiang, H. J. and Whangbo, M. H. and Kim, D. H. and Sales, B. C. and Mandrus, D.}, year={2007} } @article{kohler_friedrich_lee_whangbo_2007, title={IrIn7GeO8=[IrIn6](GeO4)(InO4) and compounds of the solid solution series [IrIn6](Ge1+xIn1-4x/O-3(8)) (0 <= x <= 0.75): First oxides containing [IrIn6] octahedra}, volume={633}, DOI={10.1002/zaac.200700126}, number={9}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Kohler, J. and Friedrich, H. A. and Lee, C. and Whangbo, M. H.}, year={2007}, pages={1464–1471} } @article{belik_koo_whangbo_tsujii_naumov_takayama-muromachi_2007, title={Magnetic properties of synthetic libethenite Cu2PO4OH: a new spin-gap system}, volume={46}, DOI={10.1021/ic7008418}, number={21}, journal={Inorganic Chemistry}, author={Belik, A. A. and Koo, H. J. and Whangbo, M. H. and Tsujii, N. and Naumov, P. and Takayama-Muromachi, E.}, year={2007}, pages={8684–8689} } @article{lee_whangbo_villesuzanne_2007, title={On the electronic structure required for the uniaxial magnetic properties of the magnetic metal SrCo6O11}, volume={19}, DOI={10.1021/cm0706191}, number={11}, journal={Chemistry of Materials}, author={Lee, C. and Whangbo, M. H. and Villesuzanne, A.}, year={2007}, pages={2712–2714} } @article{kohler_deng_lee_whangbo_2007, title={On the origin of a band gap in compounds of diamond-like structures}, volume={46}, DOI={10.1021/ic062256x}, number={6}, journal={Inorganic Chemistry}, author={Kohler, J. and Deng, S. Q. and Lee, C. and Whangbo, M. H.}, year={2007}, pages={1957–1959} } @article{clabau_rocquefelte_jobic_deniard_whangbo_garcia_le mercier_2007, title={On the phosphorescence mechanism in SrAl2O4 : Eu2+ and its codoped derivatives}, volume={9}, DOI={10.1016/j.solidstatesciences.2007.03.020}, number={7}, journal={Solid State Sciences}, author={Clabau, F. and Rocquefelte, X. and Jobic, S. and Deniard, P. and Whangbo, M. H. and Garcia, A. and Le Mercier, T.}, year={2007}, pages={608–612} } @article{koo_lee_wilson-short_dai_whangbo_2007, title={On the relevance of an antiferromagnetic dimer model for the spin-gapped magnetic solids Cu(terpy)Mo2O7 and Cu(OH)(p-pyc)H2O}, volume={46}, DOI={10.1021/ic061897p}, number={7}, journal={Inorganic Chemistry}, author={Koo, H. J. and Lee, C. and Wilson-Short, G. B. and Dai, D. and Whangbo, M. H.}, year={2007}, pages={2498–2502} } @article{lee_dieckmann_lee_whangbo_2007, title={Predicting anisotropic electrical conductivities of a magnetic insulator on the basis of its magnetic properties}, volume={19}, DOI={10.1021/cm071481p}, number={18}, journal={Chemistry of Materials}, author={Lee, K. H. and Dieckmann, R. and Lee, C. H. and Whangbo, M. H.}, year={2007}, pages={4393–4395} } @article{rocquefelte_clabau_paris_deniard_le mercier_jobic_whangbo_2007, title={Resolving the aluminum ordering in aluminosilicates by a combined experimental/theoretical study of Al-27 electric field gradients}, volume={46}, DOI={10.1021/ic7004166}, number={14}, journal={Inorganic Chemistry}, author={Rocquefelte, X. and Clabau, F. and Paris, M. and Deniard, P. and Le Mercier, T. and Jobic, S. and Whangbo, M. H.}, year={2007}, pages={5456–5458} } @article{koo_whangbo_2007, title={Spin dimer analysis of the magnetic structures of A(2)V(3)O(9) (A = Ba, Sr) and eta-Na9V14O35: Importance of the V4+-O center dot center dot center dot O-V4+ super- superexchange interactions mediated by the O-V5+-O bridges}, volume={9}, DOI={10.1016/j.solidstatesciences.2007.06.013}, number={9}, journal={Solid State Sciences}, author={Koo, H. J. and Whangbo, M. H.}, year={2007}, pages={824–832} } @article{ben yahia_gaudin_lee_whangbo_darriett_2007, title={Structural and magnetic properties of a new type of ordered oxygen-deficient perovskite, KMnVO4}, volume={19}, DOI={10.1021/cm070452b}, number={23}, journal={Chemistry of Materials}, author={Ben Yahia, H. and Gaudin, E. and Lee, C. and Whangbo, M. H. and Darriett, J.}, year={2007}, pages={5563–5569} } @article{lee_whangbo_kohler_2007, title={Stuffed graphite-like vs. stuffed diamond-like structures of the 18 valence electron compounds REAuSn (RE = sc, y, la-nd, sm, gd-lu)}, volume={633}, DOI={10.1002/zaac.200700317}, number={15}, journal={Zeitschrift fur Anorganische und Allgemeine Chemie}, author={Lee, C. and Whangbo, M. H. and Kohler, J.}, year={2007}, pages={2631–2634} } @article{koo_whangbo_2007, title={Tight-binding electronic structure study of the beta '- and beta ''-phases of the organic conducting salts (BEDT-TTF)(2)(IBr2)(0.2)(BrICI)(0.1)(ICI2)(0.7)]}, volume={28}, number={2}, journal={Bulletin of the Korean Chemical Society}, author={Koo, H. J. and Whangbo, M. H.}, year={2007}, pages={241–245} } @article{ben yahia_gaudin_darriet_dai_whangbo_2006, title={Comparison of the crystal structures and magnetic properties of the low- and high-temperature forms of AgCuPO4: Crystal structure determination, magnetic susceptibility measurements, and spin dimer analysis}, volume={45}, DOI={10.1021/ic060484l}, number={14}, journal={Inorganic Chemistry}, author={Ben Yahia, H. and Gaudin, E. and Darriet, J. and Dai, D. and Whangbo, M. H.}, year={2006}, pages={5501–5509} } @article{dai_whangbo_kohler_hoch_villesuzanne_2006, title={Electronic structure analysis of the difference between Cs2AgF4 and Rb2MnF4 in their magnetic properties and single-crystal structure determination of Rb2MnF4}, volume={18}, DOI={10.1021/cm060465+}, number={14}, journal={Chemistry of Materials}, author={Dai, D. and Whangbo, M. H. and Kohler, J. and Hoch, C. and Villesuzanne, A.}, year={2006}, pages={3281–3286} } @article{clabau_rocquefelte_le mercier_deniard_jobic_whangbo_2006, title={Formulation of phosphorescence mechanisms in inorganic solids based on a new model of defect conglomeration}, volume={18}, DOI={10.1021/cm052728q}, number={14}, journal={Chemistry of Materials}, author={Clabau, F. and Rocquefelte, X. and Le Mercier, T. and Deniard, P. and Jobic, S. and Whangbo, M. H.}, year={2006}, pages={3212–3220} } @article{koo_whangbo_2006, title={Importance of the O-M-O bridges (M = V5+, Mo6+) for the spin-exchange interactions in the magnetic oxides of Cu2+ ions bridged by MO4 tetrahedra: Spin-lattice models of Rb2Cu2(MoO4)(3), BaCu2V2O8, and KBa3Ca4Cu3V7O28}, volume={45}, DOI={10.1021/ic060392w}, number={11}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2006}, pages={4440–4447} } @article{whangbo_dai_lee_kremer_2006, title={On the conflicting pictures of magnetism for the frustrated triangular lattice antiferromagnet CuFeO2}, volume={18}, DOI={10.1021/cm052634g}, number={5}, journal={Chemistry of Materials}, author={Whangbo, M. H. and Dai, D. D. and Lee, K. S. and Kremer, R. K.}, year={2006}, pages={1268–1274} } @article{whangbo_dai_2006, title={On the disorder of the Cl atom position in and its probable effect on the magnetic properties of (CuCl)LaNb2O7}, volume={45}, DOI={10.1021/ic060104w}, number={16}, journal={Inorganic Chemistry}, author={Whangbo, M. H. and Dai, D. D.}, year={2006}, pages={6227–6234} } @article{whangbo_dai_kremer_2006, title={On the origin of the metallic and anisotropic magnetic properties of NaxCoO2 (x approximate to 0.75)}, volume={45}, DOI={10.1021/ic060691l}, number={15}, journal={Inorganic Chemistry}, author={Whangbo, M. H. and Dai, D. and Kremer, R. K.}, year={2006}, pages={5989–5995} } @article{rocquefelte_jobic_whangbo_2006, title={On the volume-dependence of the index of refraction from the viewpoint of the complex dielectric function and the Kramers-Kronig relation}, volume={110}, DOI={10.1021/jp055445u}, number={6}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Rocquefelte, X. and Jobic, S. and Whangbo, M. H.}, year={2006}, pages={2511–2514} } @article{koo_lee_whangbo_2006, title={Spin dimer analysis of the magnetic structures of Ba3Cr2O8, Ba3Mn2O8, Na4FeO4, and Ba2CoO4 with a three-dimensional network of isolated MO4 (M = Cr, Mn, Fe, Co) tetrahedra}, volume={45}, DOI={10.1021/ic061773c}, number={26}, journal={Inorganic Chemistry}, author={Koo, H. J. and Lee, K. S. and Whangbo, M. H.}, year={2006}, pages={10743–10749} } @article{deisenhofer_eremina_pimenov_gavrilova_berger_johnsson_lemmens_von nidda_loidl_lee_et al._2006, title={Structural and magnetic dimers in the spin-gapped system CuTe2O5}, volume={74}, DOI={10.1103/physrevb.74.174421}, number={17}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Deisenhofer, J. and Eremina, R. M. and Pimenov, A. and Gavrilova, T. and Berger, H. and Johnsson, M. and Lemmens, P. and Von Nidda, H. A. K. and Loidl, A. and Lee, K. S. and et al.}, year={2006} } @article{whangbo_subramanian_2006, title={Structural model of planar defects in CaCu3Ti4O12 exhibiting a giant dielectric constant}, volume={18}, DOI={10.1021/cm060323f}, number={14}, journal={Chemistry of Materials}, author={Whangbo, M. H. and Subramanian, M. A.}, year={2006}, pages={3257–3260} } @article{wang_hung_hwu_koo_whangbo_2006, title={Synthesis, structure, and properties of a new family of mixed-framework chalcohalide semiconductors: CdSbS2X (X = Cl, Br), CdBiS2X (X = Cl, Br), and CdBiSe2X (X = Br, I)}, volume={18}, DOI={10.1021/cm0522230}, number={5}, journal={Chemistry of Materials}, author={Wang, L. and Hung, Y. C. and Hwu, S. J. and Koo, H. J. and Whangbo, M. H.}, year={2006}, pages={1219–1225} } @article{whangbo_lee_kohler_2006, title={Transition-metal anions in solids and their implications on bonding}, volume={45}, DOI={10.1002/anie.200602712}, number={44}, journal={Angewandte Chemie [International Edition in English]}, author={Whangbo, M. H. and Lee, C. and Kohler, J.}, year={2006}, pages={7465–7469} } @article{manson_conner_schlueter_lancaster_blundell_brooks_pratt_papageorgiou_bianchi_wosnitza_et al._2006, title={[Cu(HF2)(pyz)(2)]BF4 (pyz=pyrazine): long-range magnetic ordering in a pseudo-cubic coordination polymer comprised of bridging HF2- and pyrazine ligands}, number={47}, journal={Chemical Communications (Cambridge, England)}, author={Manson, J. L. and Conner, M. M. and Schlueter, J. A. and Lancaster, T. and Blundell, S. J. and Brooks, M. L. and Pratt, F. L. and Papageorgiou, T. and Bianchi, A. D. and Wosnitza, J. and et al.}, year={2006}, pages={4894–4896} } @article{dai_whangbo_ugrinov_sevov_wang_li_villesuzanne_alekseyev_liebermann_buenker_2005, title={Analysis of the effect of spin-orbit coupling on the electronic structure and excitation spectrum of the Bi-2(2-) anion in (K-crypt)(2)Bi-2 on the basis of relativistic electronic structure calculations}, volume={109}, DOI={10.1021/jp044675q}, number={8}, journal={Journal of Physical Chemistry. A, Molecules, Spectroscopy, Kinetics, Environment & General Theory}, author={Dai, D. and Whangbo, M. H. and Ugrinov, A. and Sevov, S. C. and Wang, F. and Li, L. M. and Villesuzanne, A. and Alekseyev, A. B. and Liebermann, H. P. and Buenker, R. J.}, year={2005}, pages={1675–1683} } @article{rocquefelte_goubin_montardi_viadere_demourgues_tressaud_whangbo_jobic_2005, title={Analysis of the refractive indices of TiO2, TiOF2, and TiF4: Concept of optical channel as a guide to understand and design optical materials}, volume={44}, DOI={10.1021/ic048259w}, number={10}, journal={Inorganic Chemistry}, author={Rocquefelte, X. and Goubin, F. and Montardi, Y. and Viadere, N. and Demourgues, A. and Tressaud, A. and Whangbo, M. H. and Jobic, S.}, year={2005}, pages={3589–3593} } @article{dal_whangbo_koo_rocquefelte_jobic_villesuzanne_2005, title={Analysis of the spin exchange interactions and the ordered magnetic structures of lithium transition metal phosphates LiMPO4 (M = Mn, Fe, Co, Ni) with the olivine structure}, volume={44}, DOI={10.1021/ic048431w}, number={7}, journal={Inorganic Chemistry}, author={Dal, D. and Whangbo, M. H. and Koo, H. J. and Rocquefelte, X. and Jobic, S. and Villesuzanne, A.}, year={2005}, pages={2407–2413} } @article{dai_whangbo_2005, title={Analysis of the uniaxial magnetic properties of high-spin d(6) ions at trigonal prism and linear two-coordinate sites: Uniaxial magnetic properties of Ca3Co2O6 and Fe[C(SiMe3)(3)](2)}, volume={44}, DOI={10.1021/ic050185g}, number={12}, journal={Inorganic Chemistry}, author={Dai, D. D. and Whangbo, M. H.}, year={2005}, pages={4407–4414} } @article{kohler_chang_whangbo_2005, title={Bonding and oxidation state of a transition metal atom encapsulated in an isolated octahedral cluster cation of main group elements: ynthesis, crystal structure, and electronic structure of Pt2In14Ga3O8F15 ?}, volume={127}, DOI={10.1021/ja044389s}, number={7}, journal={Journal of the American Chemical Society}, author={Kohler, J. and Chang, J. H. and Whangbo, M. H.}, year={2005}, pages={2277–2284} } @article{woodward_backov_abboud_dai_koo_whangbo_meisel_talham_2005, title={Dramatic variation of magnetic exchange through double end-on azide bridges in a series of ladder-like copper(II) coordination polymers}, volume={44}, DOI={10.1021/ic049175q}, number={3}, journal={Inorganic Chemistry}, author={Woodward, J. D. and Backov, R. V. and Abboud, K. A. and Dai, D. and Koo, H. J. and Whangbo, M. H. and Meisel, M. W. and Talham, D. R.}, year={2005}, pages={638–648} } @article{koo_dai_whangbo_2005, title={Importance of supersuperexchange interactions in determining the dimensionality of magnetic properties. Determination of strongly interacting spin exchange paths in A(2)CU(PO4)(2) (A = Ba, Sr), ACuP(2)O(7) (Ba, Ca, Sr, Pb), CaCuGe2O6, and Cu2UO2(PO4)(2) o}, volume={44}, DOI={10.1021/ic050159i}, number={12}, journal={Inorganic Chemistry}, author={Koo, H. J. and Dai, D. and Whangbo, M. H.}, year={2005}, pages={4359–4365} } @article{belik_azuma_matsuo_whangbo_koo_kikuchi_kaji_okubo_ohta_kindo_et al._2005, title={Investigation of the crystal structure and the structural and magnetic properties of SrCu2(PO4)(2)}, volume={44}, DOI={10.1021/ic051079h}, number={19}, journal={Inorganic Chemistry}, author={Belik, A. A. and Azuma, M. and Matsuo, A. and Whangbo, M. H. and Koo, H. J. and Kikuchi, J. and Kaji, T. and Okubo, S. and Ohta, H. and Kindo, K. and et al.}, year={2005}, pages={6632–6640} } @article{lee_suh_lee_hwang_koo_whangbo_2005, title={Investigation of the scanning tunneling microscopy image, the stacking pattern, and the bias-voltage-dependent structural instability of 1,10 '-phenanthroline molecules adsorbed on Au(111) in terms of electronic structure calculations}, volume={109}, DOI={10.1021/jp051248j}, number={32}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Lee, K. H. and Suh, Y. and Lee, C. and Hwang, Y. G. and Koo, H. J. and Whangbo, M. H.}, year={2005}, pages={15322–15326} } @article{kim_seo_kremer_kohler_villesuzanne_whangbo_2005, title={Large negative magnetoresistance of the rare-earth transition-metal intermetallic compound PrMnSi2}, volume={17}, DOI={10.1021/cm051669d}, number={25}, journal={Chemistry of Materials}, author={Kim, S. H. and Seo, D. K. and Kremer, R. K. and Kohler, M. and Villesuzanne, A. and Whangbo, M. H.}, year={2005}, pages={6338–6341} } @article{clabau_rocquefelte_jobic_deniard_whangbo_garcia_le mercier_2005, title={Mechanism of phosphorescence appropriate for the long-lasting phosphors Eu2+-doped SrAl2O4 with codopants Dy3+ and B3+}, volume={17}, DOI={10.1021/cm050763r}, number={15}, journal={Chemistry of Materials}, author={Clabau, F. and Rocquefelte, X. and Jobic, S. and Deniard, P. and Whangbo, M. H. and Garcia, A. and Le Mercier, T.}, year={2005}, pages={3904–3912} } @article{kim_seo_kremer_kohler_villesuzanne_whangbo_2005, title={Observation of unusual hysteretic magnetic properties of the rare earth intermetallic compound PrMnSi2: Magnetic susceptibility, magnetization, heat capacity, and electronic band structure studies}, volume={17}, DOI={10.1021/cm050622p}, number={14}, journal={Chemistry of Materials}, author={Kim, S. H. and Seo, D. K. and Kremer, R. K. and Kohler, J. and Villesuzanne, A. and Whangbo, M. H.}, year={2005}, pages={3711–3716} } @article{villesuzanne_whangbo_subramanian_matar_2005, title={Spin dimer and electronic band structure analyses of the ferromagnetism versus antiferromagnetism in SeCuO3 and TeCuO3}, volume={17}, DOI={10.1021/cm050885j}, number={17}, journal={Chemistry of Materials}, author={Villesuzanne, A. and Whangbo, M. H. and Subramanian, M. A. and Matar, S. F.}, year={2005}, pages={4350–4355} } @article{whangbo_dai_koo_2005, title={Spin dimer, electronic band structure and classical spin analyses of spin exchange interactions and ordered magnetic structures of magnetic solids}, volume={7}, DOI={10.1016/j.solidstatesciences.2005.02.009}, number={7}, journal={Solid State Sciences}, author={Whangbo, M. H. and Dai, D. and Koo, H. J.}, year={2005}, pages={827–852} } @article{rocquefelte_whangbo_jobic_2005, title={Structural and electronic factors controlling the refractive indices of the chalcogenides ZnQ and CdQ (Q = O, S, Se, Te)}, volume={44}, DOI={10.1021/ic048352k}, number={10}, journal={Inorganic Chemistry}, author={Rocquefelte, X. and Whangbo, M. H. and Jobic, S.}, year={2005}, pages={3594–3598} } @article{kohler_friedrich_whangbo_villesuzanne_2005, title={Synthesis and characterization of [PtIn6](GeO4)20 and its solid solution [PtIn6](GaO4)(2-x)(GeO4)(x)O-x/2 (0 <= x <= 2): Gradual color change of the solid solution from black (x=0) to yellow (x=2) as a consequence of quantum dot effect}, volume={127}, DOI={10.1021/ja053280x}, number={37}, journal={Journal of the American Chemical Society}, author={Kohler, J. and Friedrich, H. and Whangbo, M. H. and Villesuzanne, A.}, year={2005}, pages={12990–12996} } @article{yahia_gaudin_darriet_banks_kremer_villesuzanne_whangbo_2005, title={Synthesis, crystal structure, magnetic properties, and electronic structure of the new ternary vanadate CuMnVO4}, volume={44}, DOI={10.1021/ic048244y}, number={9}, journal={Inorganic Chemistry}, author={Yahia, H. B. and Gaudin, E. and Darriet, J. and Banks, M. and Kremer, R. K. and Villesuzanne, A. and Whangbo, M. H.}, year={2005}, pages={3087–3093} } @article{xu_assoud_soheilnia_derakhshan_cuthbert_greedan_whangbo_kleinke_2005, title={Synthesis, structure, and magnetic properties of the layered copper(II) oxide Na2Cu2TeO6}, volume={44}, DOI={10.1021/ic0502832}, number={14}, journal={Inorganic Chemistry}, author={Xu, J. X. and Assoud, A. and Soheilnia, N. and Derakhshan, S. and Cuthbert, H. L. and Greedan, J. E. and Whangbo, M. H. and Kleinke, H.}, year={2005}, pages={5042–5046} } @article{cao_haraldsen_brown_musfeldt_thompson_zvyagin_krzystek_whangbo_nagler_torardi_2005, title={Understanding low-energy magnetic excitations and hydrogen bonding in VOHPO4 center dot(2H2O)-H-1}, volume={72}, DOI={10.1103/physrevb.72.214421}, number={21}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Cao, J. and Haraldsen, J. T. and Brown, S. and Musfeldt, J. L. and Thompson, J. R. and Zvyagin, S. and Krzystek, J. and Whangbo, M. H. and Nagler, S. E. and Torardi, C. C.}, year={2005} } @article{woodward_choi_musfeldt_haraldsen_wei_koo_dai_whangbo_landee_turnbull_2005, title={Understanding the color properties of (C5H9NH3)(2)CuBr4 in high magnetic fields}, volume={71}, DOI={10.1103/physrevb.71.174416}, number={17}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Woodward, J. D. and Choi, J. and Musfeldt, J. L. and Haraldsen, J. T. and Wei, X. and Koo, H. J. and Dai, D. and Whangbo, M. H. and Landee, C. P. and Turnbull, M. M.}, year={2005} } @article{villesuzanne_whangbo_koo_2005, title={Unpaired spin populations and spin-pairing tendencies of the nonequivalent vanadium sites of the magnetic metal NaV6O11 investigated by electronic band structure calculations and spin dimer analysis}, volume={17}, DOI={10.1021/cm050666y}, number={17}, journal={Chemistry of Materials}, author={Villesuzanne, A. and Whangbo, M. H. and Koo, H. J.}, year={2005}, pages={4344–4349} } @article{soulard_petit_deniard_evain_jobic_whangbo_dhaussy_2005, title={Why pressure induces an abrupt structural rearrangement in PdTe2 but not in PtTe2}, volume={178}, DOI={10.1016/j.jssc.2005.04.008}, number={6}, journal={Journal of Solid State Chemistry}, author={Soulard, C. and Petit, P. E. and Deniard, P. and Evain, M. and Jobic, S. and Whangbo, M. H. and Dhaussy, A. C.}, year={2005}, pages={2008–2014} } @article{dai_whangbo_2004, title={Classical spin and quantum-mechanical descriptions of geometric spin frustration}, volume={121}, DOI={10.1063/1.1760749}, number={2}, journal={Journal of Chemical Physics}, author={Dai, D. D. and Whangbo, M. H.}, year={2004}, pages={672–680} } @article{goubin_rocquefelte_whangbo_montardi_brec_jobic_2004, title={Experimental and theoretical characterization of the optical properties of CeO2, SrCeO3, and Sr2CeO4 containina Ce4+ (f(0)) ions}, volume={16}, DOI={10.1021/cm034618u}, number={4}, journal={Chemistry of Materials}, author={Goubin, F. and Rocquefelte, X. and Whangbo, M. H. and Montardi, Y. and Brec, R. and Jobic, S.}, year={2004}, pages={662–669} } @article{soulard_rocquefelte_petit_evain_jobic_itie_munsch_koo_whangbo_2004, title={Experimental and theoretical investigation on the relative stability of the PdS2- and pyrite-type structures of PdSe2}, volume={43}, DOI={10.1021/ic035396}, number={6}, journal={Inorganic Chemistry}, author={Soulard, C. and Rocquefelte, X. and Petit, P. E. and Evain, M. and Jobic, S. and Itie, J. P. and Munsch, P. and Koo, H. J. and Whangbo, M. H.}, year={2004}, pages={1943–1949} } @article{ammar_menetrier_villesuzanne_matar_chevalier_etourneau_villeneuve_rodriguez-carvajal_koo_smirnov_et al._2004, title={Investigation of the electronic and structural properties of potassium hexaboride, KB6, by transport, magnetic susceptibility, EPR, and NMR measurements, temperature-dependent crystal structure determination, and electronic band structure calculations}, volume={43}, url={http://www.scopus.com/inward/record.url?eid=2-s2.0-3843112209&partnerID=MN8TOARS}, DOI={10.1021/ic049444c}, number={16}, journal={Inorganic Chemistry}, author={Ammar, A. and Menetrier, M. and Villesuzanne, A. and Matar, S. and Chevalier, B. and Etourneau, J. and Villeneuve, G. and Rodriguez-Carvajal, J. and Koo, H. J. and Smirnov, Alex I. and et al.}, year={2004}, pages={4974–4987} } @article{dai_koo_whangbo_2004, title={Investigation of the incommensurate and commensurate magnetic superstructures of LiCuVO4 and CuO on the basis of the isotropic spin exchange and classical spin approximations}, volume={43}, DOI={10.1021/ic035314c}, number={13}, journal={Inorganic Chemistry}, author={Dai, D. and Koo, H. J. and Whangbo, M. H.}, year={2004}, pages={4026–4035} } @article{rocquefelte_goubin_koo_whangbo_jobic_2004, title={Investigation of the origin of the empirical relationship between refractive index and density on the basis of first principles calculations for the refractive indices of various TiO2 phases}, volume={43}, DOI={10.1021/ic035383r}, number={7}, journal={Inorganic Chemistry}, author={Rocquefelte, X. and Goubin, F. and Koo, H. J. and Whangbo, M. H. and Jobic, S.}, year={2004}, pages={2246–2251} } @article{soulard_rocquefelte_evain_jobic_koo_whangbo_2004, title={Investigation of the relative stabilities of various allotropic phases of elemental tellurium under pressure and their interconversion paths by electronic structure calculations and crystal structure analyses}, volume={177}, DOI={10.1016/j.jssc.2004.08.040}, number={12}, journal={Journal of Solid State Chemistry}, author={Soulard, C. and Rocquefelte, X. and Evain, M. and Jobic, S. and Koo, H. and Whangbo, M. H.}, year={2004}, pages={4724–4731} } @article{choi_woodward_musfeldt_wei_whangbo_he_jin_mandrus_2004, title={Magneto-optical properties of Li0.9Mo6O17: Color change in applied magnetic field}, volume={70}, DOI={10.1103/physrevb.70.085107}, number={8}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Choi, J. and Woodward, J. D. and Musfeldt, J. L. and Wei, X. and Whangbo, M. H. and He, J. and Jin, R. and Mandrus, D.}, year={2004} } @article{manson_schlueter_koo_whangbo_2004, title={Reexamination of the magnetic properties of Cu-2(dca)(4)(2,5-me(2)pyz) {dca = dicyanamide; me(2)pyz = dimethylpyrazine}: isolated spin-1/2 dimers versus long-range magnetic ordering}, volume={43}, DOI={10.1021/ic0354769}, number={13}, journal={Inorganic Chemistry}, author={Manson, J. L. and Schlueter, J. A. and Koo, H. J. and Whangbo, M. H.}, year={2004}, pages={4007–4011} } @article{whangbo_dai_koo_2004, title={Spin dimer and classical spin analyses of the ordered magnetic structures of alkali iron pyrophosphates NaFeP2O7 and LiFeP2O7}, number={19}, journal={Dalton Transactions (Cambridge, England : 2003)}, author={Whangbo, M. H. and Dai, D. and Koo, H. J.}, year={2004}, pages={3019–3025} } @article{shikano_kremer_ahrens_koo_whangbo_darriet_2004, title={Synthesis and characterization of a magnetic semiconductor Na2RuO4 containing one-dimensional chains of RU6+}, volume={43}, number={1}, journal={Inorganic Chemistry}, author={Shikano, M. and Kremer, R. K. and Ahrens, M. and Koo, H. J. and Whangbo, M. H. and Darriet, J.}, year={2004}, pages={07-} } @article{goubin_guenee_deniard_koo_whangbo_montardi_jobic_2004, title={Synthesis, optical properties and electronic structures of polyoxometalates K3P(Mo1-xWx)(12)O-40 (0 <= x <= 1)}, volume={177}, DOI={10.1016/j.jssc.2004.08.046}, number={12}, journal={Journal of Solid State Chemistry}, author={Goubin, F. and Guenee, L. and Deniard, P. and Koo, H. J. and Whangbo, M. H. and Montardi, Y. and Jobic, S.}, year={2004}, pages={4528–4534} } @article{whangbo_koo_dai_villesuzanne_2003, title={A discussion on the apparently puzzling structural, electrical and magnetic properties of BaVS3}, volume={175}, DOI={10.1016/S0022-4596(03)00346-3}, number={2}, journal={Journal of Solid State Chemistry}, author={Whangbo, M. H. and Koo, H. J. and Dai, D. and Villesuzanne, A.}, year={2003}, pages={384–388} } @article{dai_koo_whangbo_2003, title={Analysis of the spin exchange interactions of ferromagnetic CdVO3 in terms of first principles and qualitative electronic structure calculations}, volume={175}, DOI={10.1016/S0022-4596(03)00307-4}, number={2}, journal={Journal of Solid State Chemistry}, author={Dai, D. and Koo, H. J. and Whangbo, M. H.}, year={2003}, pages={341–347} } @article{manson_lecher_gu_geiser_schlueter_henning_wang_schultz_koo_whangbo_2003, title={Cu(HCO2)(2)L {L = pyrazine, 4,4 '-bipyridine}: employing the formate anion as a building block in three-dimensional coordination polymers}, DOI={10.1039/b302631k}, number={14}, journal={Dalton Transactions (Cambridge, England : 2003)}, author={Manson, J. L. and Lecher, J. G. and Gu, J. Y. and Geiser, U. and Schlueter, J. A. and Henning, R. and Wang, X. P. and Schultz, A. J. and Koo, H. J. and Whangbo, M. H.}, year={2003}, pages={2905–2911} } @article{whangbo_koo_dai_jung_2003, title={Interpretation of the magnetic structures of Cu2Te2O5X2 (X = Cl, Br) and Ca3.1Cu0.9RuO6 on the basis of electronic structure considerations: Cases for strong super-superexchange interactions involving Cu2+ ions}, volume={42}, DOI={10.1021/ic020551}, number={12}, journal={Inorganic Chemistry}, author={Whangbo, M. H. and Koo, H. J. and Dai, D. and Jung, D.}, year={2003}, pages={3898–3906} } @article{koo_whangbo_lee_2003, title={Investigation of the spin exchange interactions and magnetic structures of the CrVO4-type transition metal phosphates, sulfates, and vanadates by spin dimer analysis}, volume={42}, DOI={10.1021/ic030115e}, number={19}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H. and Lee, K.}, year={2003}, pages={5932–5937} } @article{whangbo_dai_koo_jobic_2003, title={Investigations of the oxidation states and spin distributions in Ca3Co2O6 and Ca3CoRhO6 by spin-polarized electronic band structure calculations}, volume={125}, DOI={10.1016/S0038-1098(02)00872-4}, number={7-8}, journal={Solid State Communications}, author={Whangbo, M. H. and Dai, D. and Koo, H. J. and Jobic, S.}, year={2003}, pages={413–417} } @article{koo_whangbo_2003, title={Magnetic superstructures of cupric oxide CuO as ordered arrangements of one-dimensional antiferromagnetic chains}, volume={42}, DOI={10.1021/ic020576k}, number={4}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2003}, pages={1187–1192} } @article{soulard_rocquefelte_jobic_dai_koo_whangbo_2003, title={Metal-ligand bonding and rutile- versus CdI2-type structural preference in platinum dioxide and titanium dioxide}, volume={175}, DOI={10.1016/S0022-4596(03)00323-2}, number={2}, journal={Journal of Solid State Chemistry}, author={Soulard, C. and Rocquefelte, X. and Jobic, S. and Dai, D. and Koo, H. J. and Whangbo, M. H.}, year={2003}, pages={353–358} } @article{whangbo_koo_dai_2003, title={Spin exchange interactions and magnetic structures of extended magnetic solids with localized spins: theoretical descriptions on formal, quantitative and qualitative levels}, volume={176}, DOI={10.1016/S0022-4596(03)00273-1}, number={2}, journal={Journal of Solid State Chemistry}, author={Whangbo, M. H. and Koo, H. J. and Dai, D.}, year={2003}, pages={417–481} } @article{dai_whangbo_2003, title={Spin exchange interactions of a spin dimer: Analysis of broken- symmetry spin states in terms of the eigenstates of Heisenberg and Ising spin Hamiltonians}, volume={118}, DOI={10.1063/1.1525809}, number={1}, journal={Journal of Chemical Physics}, author={Dai, D. D. and Whangbo, M. H.}, year={2003}, pages={29–39} } @article{gauthier_jobic_evain_koo_whangbo_fouassier_brec_2003, title={Syntheses, structures, and optical properties of yellow Ce2SiS5, Ce6Si4S17, and Ce4Si3S12 materials}, volume={15}, DOI={10.1021/cm0211711}, number={4}, journal={Chemistry of Materials}, author={Gauthier, G. and Jobic, S. and Evain, M. and Koo, H. J. and Whangbo, M. H. and Fouassier, C. and Brec, R.}, year={2003}, pages={828–837} } @article{montgomery_starkey_engel_bollinger_tittelbach_schweitzer_heinen_koo_whangbo_2003, title={Synthesis of the highly ID conductor (THTTF)(4)I-19}, volume={133}, DOI={10.1016/S0379-6779(02)00409-5}, number={2003 Mar 13}, journal={Synthetic Metals}, author={Montgomery, L. K. and Starkey, K. P. and Engel, D. B. and Bollinger, J. and Tittelbach, M. and Schweitzer, D. and Heinen, I. and Koo, H. J. and Whangbo, M. H.}, year={2003}, pages={381–383} } @article{shultz_vostrikova_bodnar_koo_whangbo_kirk_depperman_kampf_2003, title={Trends in metal-biradical exchange interaction for first-row M- II(nitronyl nitroxide-semiquinone) complexes}, volume={125}, DOI={10.1021/ja020715x}, number={6}, journal={Journal of the American Chemical Society}, author={Shultz, David and Vostrikova, K. E. and Bodnar, S. H. and Koo, H. J. and Whangbo, M. H. and Kirk, M. L. and Depperman, E. C. and Kampf, J. W.}, year={2003}, pages={1607–1617} } @article{dai_koo_whangbo_soulard_rocquefelte_jobic_2003, title={Trends in the structure and bonding in the layered platinum dioxide and dichalcogenides PtQ(2) (Q = O, S, Se, Te)}, volume={173}, DOI={10.1016/s0022-4596(03)00100-2}, number={1}, journal={Journal of Solid State Chemistry}, author={Dai, D. and Koo, H. J. and Whangbo, M. H. and Soulard, C. and Rocquefelte, X. and Jobic, S.}, year={2003}, pages={114–121} } @article{etourneau_ammar_villesuzanne_villeneuve_chevalier_whangbo_2003, title={Unusual hysteresis in the magnetic susceptibility of cubic hexaboride KB6}, volume={42}, DOI={10.1021/ic034018x}, number={14}, journal={Inorganic Chemistry}, author={Etourneau, J. and Ammar, A. and Villesuzanne, A. and Villeneuve, G. and Chevalier, B. and Whangbo, M. H.}, year={2003}, pages={4242–4244} } @article{deplano_leoni_mercuri_schlueter_geiser_wang_kini_manson_gomez-garcia_coronado_et al._2002, title={A two-dimensional radical salt based upon BEDT-TTF and the dimeric, magnetic anion [Fe(tdas)(2)](2)(2-): (BEDT- TTF)(2)[Fe(tdas)(2)] (tdas=1,2,5-thiadiazole-3,4-dithiolate)}, volume={12}, DOI={10.1039/b204435h}, number={12}, journal={Journal of Materials Chemistry}, author={Deplano, P. and Leoni, L. and Mercuri, M. L. and Schlueter, J. A. and Geiser, U. and Wang, H. H. and Kini, A. M. and Manson, J. L. and Gomez-Garcia, C. J. and Coronado, E. and et al.}, year={2002}, pages={3570–3577} } @article{whangbo_koo_dai_villesuzanne_2002, title={Analysis of the electron localization, the anisotropy of electrical conductivity, the orbital ordering, and spin- exchange interactions in BaVS3 on the basis of first principles and semi-empirical electronic structure calculations}, volume={165}, DOI={10.1006/jssc.2002.9550}, number={2}, journal={Journal of Solid State Chemistry}, author={Whangbo, M. H. and Koo, H. J. and Dai, D. and Villesuzanne, A.}, year={2002}, pages={345–358} } @article{zhu_musfeldt_koo_whangbo_teweldemedhin_greenblatt_2002, title={Dimensionality effects on the optical properties of (PO2)(4)(WO3)(2m) (m=2, 4, 6, 7)}, volume={14}, DOI={10.1021/cm011675j}, number={6}, journal={Chemistry of Materials}, author={Zhu, Z. T. and Musfeldt, J. L. and Koo, H. J. and Whangbo, M. H. and Teweldemedhin, Z. S. and Greenblatt, M.}, year={2002}, pages={2607–2615} } @article{whangbo_koo_dai_jung_2002, title={Effect of metal-ligand bond lengths on superexchange interactions in Jahn-Teller d(4) ion systems: Spin dimer analysis of the magnetic structure of marokite CaMn2O4}, volume={41}, DOI={10.1021/ic0202458}, number={21}, journal={Inorganic Chemistry}, author={Whangbo, M. H. and Koo, H. J. and Dai, D. and Jung, D.}, year={2002}, pages={5575–5581} } @article{whangbo_koo_villesuzanne_pouchard_2002, title={Effect of metal-oxygen covalent bonding on the competition between Jahn-Teller distortion and charge disproportionation in the perovskites of high-spin d(4) metal ions LaMnO3 and CaFeO3}, volume={41}, DOI={10.1021/ic0110427}, number={7}, journal={Inorganic Chemistry}, author={Whangbo, M. H. and Koo, H. J. and Villesuzanne, A. and Pouchard, M.}, year={2002}, pages={1920–1929} } @article{rozier_galy_chelkowska_koo_whangbo_2002, title={Electrical resistivity, magnetic susceptibility, X-ray photoelectron spectroscopy, and electronic band structure studies of Cu-2.33-xV4O11}, volume={166}, DOI={10.1006/jssc.2002.9609}, number={2}, journal={Journal of Solid State Chemistry}, author={Rozier, P. and Galy, J. and Chelkowska, G. and Koo, H. J. and Whangbo, M. H.}, year={2002}, pages={382–388} } @article{dumas_tholence_continentino_fernandes_guimaraes_whangbo_2002, title={Electron paramagnetic resonance in the quasi-two dimensional magnetic ludwigite Fe3O2BO3}, volume={12}, DOI={10.1051/jo4:20020435}, number={PR9}, journal={Journal de Physique. IV}, author={Dumas, J. and Tholence, J. L. and Continentino, M. and Fernandes, J. C. and Guimaraes, R. B. and Whangbo, M. H.}, year={2002}, pages={351–354} } @article{koo_whangbo_vernooy_torardi_marshall_2002, title={Flux growth of vanadyl pyrophosphate, (VO)(2)P2O7, and spin dimer analysis of the spin exchange interactions of (VO)(2)P2O7 and vanadyl hydrogen phosphate, VO(HPO4)center dot 0.5H(2)O}, volume={41}, DOI={10.1021/ic020249c}, number={18}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H. and Vernooy, P. D. and Torardi, C. C. and Marshall, W. J.}, year={2002}, pages={4664–4672} } @article{garlach_musfeldt_pigos_jones_olejniczak_graja_whangbo_schlueter_geiser_winter_et al._2002, title={Local and spatial disorder in beta ''-(ET)(2)SF5RSO3 solid solutions (R = CH2CF2, CHF, CHFCF2)}, volume={14}, DOI={10.1021/cm010378b}, number={7}, journal={Chemistry of Materials}, author={Garlach, A. D. and Musfeldt, J. L. and Pigos, J. M. and Jones, B. R. and Olejniczak, I. and Graja, A. and Whangbo, M. H. and Schlueter, J. A. and Geiser, U. and Winter, R. W. and et al.}, year={2002}, pages={2969–2976} } @article{clayhold_ulutagay-kartin_hwu_koo_whangbo_voigt_eaiprasertsak_2002, title={Magnetic properties of the low-dimensional cuprate Na5RbCu4(AsO4)(4)Cl-2}, volume={66}, number={5}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Clayhold, J. A. and Ulutagay-Kartin, M. and Hwu, S. J. and Koo, H. J. and Whangbo, M. H. and Voigt, A. and Eaiprasertsak, K.}, year={2002}, pages={052403–1} } @article{el abed_gaudin_darriet_whangbo_2002, title={Magnetic susceptibility and spin exchange interactions of the hexagonal perovskite-type oxides Sr-4/3(Mn2/3Ni1/3)O-3}, volume={163}, DOI={10.1006/jssc.2001.9439}, number={2}, journal={Journal of Solid State Chemistry}, author={El Abed, A. and Gaudin, E. and Darriet, J. and Whangbo, M. H.}, year={2002}, pages={513–518} } @article{choi_musfeldt_wang_koo_whangbo_galy_millet_2002, title={Optical investigation of Na2V3O7 nanotubes}, volume={14}, DOI={10.1021/cm010965x}, number={2}, journal={Chemistry of Materials}, author={Choi, J. and Musfeldt, J. L. and Wang, Y. J. and Koo, H. J. and Whangbo, M. H. and Galy, J. and Millet, P.}, year={2002}, pages={924–930} } @article{whangbo_koo_2002, title={Orbital interaction analysis of cooperative Jahn-Teller distortion, orbital ordering, spin ordering, and spin exchange interactions in magnetic solids}, volume={4}, DOI={10.1016/S1293-2558(01)01261-4}, number={3}, journal={Solid State Sciences}, author={Whangbo, M. H. and Koo, H. J.}, year={2002}, pages={335–346} } @article{anokhina_day_meyer_strobele_kauzlarich_kim_whangbo_lachgar_2002, title={Preparation, structure, and properties of a series of anisotropic oxychloride cluster compounds A(x)Nb(6)Cl(12)O(2) (A=K, Rb, Cs, or In)}, volume={338}, DOI={10.1016/S0925-8388(02)00234-7}, number={1-2}, journal={Journal of Alloys and Compounds}, author={Anokhina, E. V. and Day, C. S. and Meyer, H. J. and Strobele, M. and Kauzlarich, S. M. and Kim, H. and Whangbo, M. H. and Lachgar, A.}, year={2002}, pages={218–228} } @article{whangbo_koo_2002, title={Spin dimer analysis of the spin exchange interactions in paramelaconite Cu4O3 and its analogue Ag2Cu2O3 and the spin ordering of the Cu2O3 spin lattice leading to their magnetic phase transitions}, volume={41}, DOI={10.1021/ic020141x}, number={13}, journal={Inorganic Chemistry}, author={Whangbo, M. H. and Koo, H. J.}, year={2002}, pages={3570–3577} } @article{koo_whangbo_lee_2002, title={Spin dimer analysis of the three-dimensional antiferromagnetic ordering in the quaternary manganese sulfides BaLn(2)MnS(5) (Ln = La, Ce, Pr)}, volume={169}, DOI={10.1016/S0022-4596(02)00021-X}, number={2}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Whangbo, M. H. and Lee, K. S.}, year={2002}, pages={143–148} } @article{whangbo_koo_dumas_continentino_2002, title={Theoretical investigation of the spin exchange interactions and magnetic properties of the homometallic ludwigite Fe3O2BO3}, volume={41}, DOI={10.1021/ic010956q}, number={8}, journal={Inorganic Chemistry}, author={Whangbo, M. H. and Koo, H. J. and Dumas, J. and Continentino, M. A.}, year={2002}, pages={2193–2201} } @article{schlueter_geiser_wang_kini_ward_parakka_daugherty_kelly_nixon_winter_et al._2002, title={Trifluoromethylsulfonyl-based salts of BEDT-TTF: Crystal and electronic structures and physical properties}, volume={168}, DOI={10.1006/jssc.2002.9750}, number={2}, journal={Journal of Solid State Chemistry}, author={Schlueter, J. A. and Geiser, U. and Wang, H. H. and Kini, A. M. and Ward, B. H. and Parakka, J. P. and Daugherty, R. G. and Kelly, M. E. and Nixon, P. G. and Winter, R. W. and et al.}, year={2002}, pages={524–534} } @article{koo_seo_whangbo_2001, title={Consequence of the metal-atom clustering on the magnetic properties in vanadium sulfide V5S8}, volume={160}, DOI={10.1006/jssc.2001.9260}, number={1}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Seo, D. K. and Whangbo, M. H.}, year={2001}, pages={287–291} } @article{schlueter_ward_geiser_wang_kini_parakka_morales_koo_whangbo_winter_et al._2001, title={Crystal structure, physical properties and electronic structure of a new organic conductor beta ''-(BEDT-TTF)(2)SF5CHFCF2SO3}, volume={11}, DOI={10.1039/b008735l}, number={8}, journal={Journal of Materials Chemistry}, author={Schlueter, J. A. and Ward, B. H. and Geiser, U. and Wang, H. H. and Kini, A. M. and Parakka, J. and Morales, E. and Koo, H. J. and Whangbo, M. H. and Winter, R. W. and et al.}, year={2001}, pages={2008–2013} } @article{jung_koo_dai_whangbo_2001, title={Electronic structure study of scanning tunneling microscopy images of the rutile TiO2(110) surface and their implications on the surface relaxation}, volume={473}, DOI={10.1016/S0039-6028(00)00970-5}, number={3}, journal={Surface Science}, author={Jung, D. and Koo, H. J. and Dai, D. and Whangbo, M. H.}, year={2001}, pages={193–202} } @article{rudko_long_musfeldt_koo_whangbo_revcolevschi_dhalenne_bernholdt_2001, title={Electronic transitions in doped and undoped copper germanate}, volume={13}, DOI={10.1021/cm000703f}, number={3}, journal={Chemistry of Materials}, author={Rudko, G. Y. and Long, V. C. and Musfeldt, J. L. and Koo, H. J. and Whangbo, M. H. and Revcolevschi, A. and Dhalenne, G. and Bernholdt, D. E.}, year={2001}, pages={939–944} } @article{koo_whangbo_2001, title={Examination of the anisotropic spin exchange interactions of CuM2O6 (M = Sb, V, Nb) by spin dimer analysis}, volume={156}, DOI={10.1006/jssc.2000.8969}, number={1}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2001}, pages={110–116} } @article{gourdon_jeanneau_evain_jobic_brec_koo_whangbo_2001, title={Influence of the metal-metal sigma bonding on the structures and physical properties of the hexagonal perovskite-typesulfides Sr9/8TiS3,Sr8/7TiS3, and Sr-8/7[Ti6/7Fe1/7]S-3}, volume={162}, DOI={10.1006/jssc.2001.9361}, number={1}, journal={Journal of Solid State Chemistry}, author={Gourdon, O. and Jeanneau, E. and Evain, M. and Jobic, S. and Brec, R. and Koo, H.-J. and Whangbo, M. H.}, year={2001}, pages={103–112} } @article{pigos_jones_zhu_musfeldt_homes_koo_whangbo_schlueter_ward_wang_et al._2001, title={Infrared and optical properties of beta '-(ET)(2)SF5CF2SO3: Evidence for a 45 K spin peierls transition}, volume={13}, DOI={10.1021/cm000839d}, number={4}, journal={Chemistry of Materials}, author={Pigos, J. M. and Jones, B. R. and Zhu, Z. T. and Musfeldt, J. L. and Homes, C. C. and Koo, H. J. and Whangbo, M. H. and Schlueter, J. A. and Ward, B. H. and Wang, H. H. and et al.}, year={2001}, pages={1326–1333} } @article{bar_delineau_hafele_whangbo_2001, title={Investigation of the stiffness change in, the indentation force and the hydrophobic recovery of plasma-oxidized polydimethylsiloxane surfaces by tapping mode atomic force microscopy}, volume={42}, DOI={10.1016/s0032-3861(00)00738-2}, number={8}, journal={Polymer}, author={Bar, G. and Delineau, L. and Hafele, A. and Whangbo, M. H.}, year={2001}, pages={3627–3632} } @article{manson_huang_lynn_koo_whangbo_bateman_otsuka_wada_argyriou_miller_2001, title={Long-range magnetic order in Mn[N(CN)(2)](2)(pyz) {pyz =pyrazine} susceptibility, magnetization, specific heat, and neutron diffraction measurements and electronic structure calculations}, volume={123}, DOI={10.1021/ja0024791}, number={1}, journal={Journal of the American Chemical Society}, author={Manson, J. L. and Huang, Q. Z. and Lynn, J. W. and Koo, H. J. and Whangbo, M. H. and Bateman, R. and Otsuka, T. and Wada, N. and Argyriou, D. N. and Miller, J. S.}, year={2001}, pages={162–172} } @article{gourdon_evain_jobic_brec_koo_whangbo_corraze_chauvet_2001, title={On the origin of the root 7 x root 7 superstructure and the anomalous magnetic and transport properties of the layered compound Sr6V9S22O2}, volume={40}, DOI={10.1021/ic001434y}, number={12}, journal={Inorganic Chemistry}, author={Gourdon, O. and Evain, M. and Jobic, S. and Brec, R. and Koo, H. J. and Whangbo, M. H. and Corraze, B. and Chauvet, O.}, year={2001}, pages={2898–2904} } @article{whangbo_koo_lee_gourdon_evain_jobic_brec_2001, title={On the structural and electronic factors governing the magnetic properties of the hexagonal perovskite-type oxides A(x)BO(3) (A= Ca, Sr, Ba; B = Co, Ni)}, volume={160}, DOI={10.1006/jssc.2001.9230}, number={1}, journal={Journal of Solid State Chemistry}, author={Whangbo, M. H. and Koo, H. J. and Lee, K. S. and Gourdon, O. and Evain, M. and Jobic, S. and Brec, R.}, year={2001}, pages={239–246} } @article{olejniczak_jones_dong_pigos_zhu_garlach_musfeldt_koo_whangbo_schlueter_et al._2001, title={Optical studies of the beta ''-(ET)(2)SF5RSO3 (R=CH2CF2, CHFCF2 and CHF) system: chemical tuning of the counterion}, volume={120}, DOI={10.1016/S0379-6779(00)00896-1}, number={1-3}, journal={Synthetic Metals}, author={Olejniczak, I. and Jones, B. R. and Dong, J. and Pigos, J. M. and Zhu, Z. and Garlach, A. D. and Musfeldt, J. L. and Koo, H. J. and Whangbo, M. H. and Schlueter, J. A. and et al.}, year={2001}, pages={785–786} } @article{koo_whangbo_coste_jobic_2001, title={Spin dimer analysis for antiferromagnetic spin exchange interactions of magnetic solids with several unpaired electrons per spin site: Trends in the spin exchange parameters of the compounds consisting of MnF5 chains and CrX2 (X = O, S) layers}, volume={156}, DOI={10.1006/jssc.2000.9025}, number={2}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Whangbo, M. H. and Coste, S. and Jobic, S.}, year={2001}, pages={464–469} } @article{koo_whangbo_2001, title={Spin dimer analysis of the anisotropic spin exchange interactions in the distorted wolframite-type oxides CuWO4, CuMoO4-III, and Cu(Mo0.25W0.(75))O-4}, volume={40}, DOI={10.1021/ic001445r}, number={9}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2001}, pages={2161–2169} } @article{dai_whangbo_2001, title={Spin-Hamiltonian and density functional theory descriptions of spin exchange interactions}, volume={114}, DOI={10.1063/1.1342758}, number={7}, journal={Journal of Chemical Physics}, author={Dai, D. D. and Whangbo, M. H.}, year={2001}, pages={2887–2893} } @article{whangbo_koo_2001, title={Structural and electronic features of BaIrO3 causing the simultaneous occurrence of weak ferromagnetism and charge density wave formation}, volume={118}, DOI={10.1016/S0038-1098(01)00166-1}, number={10}, journal={Solid State Communications}, author={Whangbo, M. H. and Koo, H. J.}, year={2001}, pages={491–495} } @article{jobic_brec_pasturel_koo_whangbo_2001, title={Theoretical study of possible iridium ditelluride phases attainable under high pressure}, volume={162}, DOI={10.1006/jssc.2001.9341}, number={1}, journal={Journal of Solid State Chemistry}, author={Jobic, S. and Brec, R. and Pasturel, A. and Koo, H. J. and Whangbo, M. H.}, year={2001}, pages={63–68} } @article{gourdon_hanko_boucher_petricek_whangbo_kanatzidis_evain_2000, title={A unique distortion in K1/3Ba2/3AgTe2: X-ray diffraction determination and electronic band structure analysis of its incommensurately modulated structure}, volume={39}, DOI={10.1021/ic991457g}, number={7}, journal={Inorganic Chemistry}, author={Gourdon, O. and Hanko, J. and Boucher, F. and Petricek, V. and Whangbo, M. H. and Kanatzidis, M. G. and Evain, M.}, year={2000}, pages={1398–1409} } @article{whangbo_koo_lee_2000, title={Analysis of nearest-neighbor spin exchange interactions by molecular orbital calculations: anisotropic spin exchange interactions in MV3O7 (M = Cd, Ca, Sr) and alpha '-NaV2O5}, volume={114}, DOI={10.1016/s0038-1098(99)00571-2}, number={1}, journal={Solid State Communications}, author={Whangbo, M. H. and Koo, H. J. and Lee, K. S.}, year={2000}, pages={27–32} } @article{koo_whangbo_2000, title={Analysis of the spin exchange interactions in the extended magnetic solids K2NiF4, K2CuF4, La2CuO4, Nd2CuO4, KNiF3, and KCuF3}, volume={151}, DOI={10.1006/jssc.2000.8627}, number={1}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2000}, pages={96–101} } @article{koo_whangbo_2000, title={Analysis of the spin exchange interactions in the three phases of vanadium pyrophosphate, (VO)(2)P2O7, in terms of spin- orbital interaction energy}, volume={39}, DOI={10.1021/ic000046t}, number={16}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2000}, pages={3599–3604} } @article{bengel_jobic_moelo_lafond_rouxel_seo_whangbo_2000, title={Distribution of the Pb and Sb atoms in the (Pb, Sb)S layers of the Franckeite-type misfit compound [(Pb, Sb)S](2.28)NbS2 examined by scanning tunneling and atomic force microscopy}, volume={149}, DOI={10.1006/jssc.1999.8552}, number={2}, journal={Journal of Solid State Chemistry}, author={Bengel, H. and Jobic, S. and Moelo, Y. and Lafond, A. and Rouxel, J. and Seo, D. K. and Whangbo, M. H.}, year={2000}, pages={370–377} } @article{koo_whangbo_picard_jobic_potel_gougeon_2000, title={Electronic band structure study of A(2)Mo(9)S(11) (A=K, Rb) and K1.8Mo9S11}, volume={155}, DOI={10.1006/jssc.2000.8912}, number={1}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Whangbo, M. H. and Picard, S. and Jobic, S. and Potel, M. and Gougeon, P.}, year={2000}, pages={124–128} } @article{bar_ganter_brandsch_delineau_whangbo_2000, title={Examination of butadiene/styrene-co-butadiene rubber blends by tapping mode atomic force microscopy. Importance of the indentation depth and reduced tip-sample energy dissipation in tapping mode atomic force microscopy study of elastomers}, volume={16}, DOI={10.1021/la9913699}, number={13}, journal={Langmuir}, author={Bar, G. and Ganter, M. and Brandsch, R. and Delineau, L. and Whangbo, M. H.}, year={2000}, pages={5702–5711} } @misc{bar_brandsch_bruch_delineau_whangbo_2000, title={Examination of the relationship between phase shift and energy dissipation in tapping mode atomic force microscopy by frequency-sweep and force-probe measurements}, volume={444}, DOI={10.1016/s0039-6028(99)00975-9}, number={1-3}, journal={Surface Science}, author={Bar, G. and Brandsch, R. and Bruch, M. and Delineau, L. and Whangbo, M. H.}, year={2000}, pages={L11–16} } @misc{delineau_brandsch_bar_whangbo_2000, title={Harmonic responses of a cantilever interacting with elastomers in tapping mode atomic force microscopy}, volume={448}, DOI={10.1016/s0039-6028(00)00045-5}, number={1}, journal={Surface Science}, author={Delineau, L. and Brandsch, R. and Bar, G. and Whangbo, M. H.}, year={2000}, pages={L179–187} } @article{bar_delineau_brandsch_ganter_whangbo_2000, title={Hysteresis in the distance-sweep curves of elastomers and its implications in tapping mode atomic force microscopy}, volume={457}, DOI={10.1016/S0039-6028(00)00414-3}, number={1-2}, journal={Surface Science}, author={Bar, G. and Delineau, L. and Brandsch, R. and Ganter, M. and Whangbo, M. H.}, year={2000}, pages={L404–412} } @article{whangbo_koo_2000, title={Investigation of the spin exchange interactions in the nanotube system Na2V3O7 by spin dimer analysis}, volume={115}, DOI={10.1016/S0038-1098(00)00258-1}, number={12}, journal={Solid State Communications}, author={Whangbo, M. H. and Koo, H. J.}, year={2000}, pages={675–678} } @article{schiller_schmidt_balthes_schweitzer_koo_whangbo_heinen_klausa_kircher_strunz_2000, title={Investigations of the Fermi surface of a new organic metal: (BEDT-TTF)(4)[Ni(dto)(2)]}, volume={51}, DOI={10.1209/epl/i2000-00329-2}, number={1}, journal={Europhysics Letters}, author={Schiller, M. and Schmidt, W. and Balthes, E. and Schweitzer, D. and Koo, H. J. and Whangbo, M. H. and Heinen, I. and Klausa, T. and Kircher, P. and Strunz, W.}, year={2000}, pages={82–88} } @article{hagrman_laduca_koo_rarig_haushalter_whangbo_zubieta_2000, title={Ligand influences on the structures of molybdenum oxide networks}, volume={39}, DOI={10.1021/ic0004961}, number={19}, journal={Inorganic Chemistry}, author={Hagrman, P. J. and Laduca, R. L. and Koo, H. J. and Rarig, R. and Haushalter, R. C. and Whangbo, M. H. and Zubieta, J.}, year={2000}, pages={4311–4317} } @article{bartlett_essex_koo_nandhakumar_robertson_whangbo_2000, title={Molecular self-assembly on surfaces of organic conducting salts: Epitaxial monolayer films of naphthalene on the (001) surface of (TMTSF)(2)PF6}, volume={104}, DOI={10.1021/jp000013z}, number={31}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Bartlett, P. N. and Essex, J. W. and Koo, H. J. and Nandhakumar, I. S. and Robertson, N. and Whangbo, M. H.}, year={2000}, pages={7394–7402} } @article{jones_olejniczak_dong_pigos_zhu_garlach_musfeldt_koo_whangbo_schlueter_et al._2000, title={Optical spectra and electronic band structure calculations of beta ''-(ET)(2)SF5RSO3 (R = CH2CF2, CHFCF2, and CHF): Changing electronic properties by chemical tuning of the counterion}, volume={12}, DOI={10.1021/cm000349l}, number={8}, journal={Chemistry of Materials}, author={Jones, B. R. and Olejniczak, I. and Dong, J. and Pigos, J. M. and Zhu, Z. T. and Garlach, A. D. and Musfeldt, J. L. and Koo, H. J. and Whangbo, M. H. and Schlueter, J. A. and et al.}, year={2000}, pages={2490–2495} } @article{whangbo_koo_2000, title={Origin of the spin gap in sodium vanadium bronze Na9V14O35}, volume={115}, DOI={10.1016/S0038-1098(00)00159-9}, number={3}, journal={Solid State Communications}, author={Whangbo, M. H. and Koo, H. J.}, year={2000}, pages={115–119} } @article{whangbo_2000, title={Perspective on 'An extended Huckel theory. I. Hydrocarbons': Hoffmann, R. ; (1963) J. Chem. Phys., Vol. 39: pg. 1397-1412}, volume={103}, DOI={10.1007/s002149900064}, number={3-4}, journal={Theoretical Chemistry Accounts}, author={Whangbo, M. H.}, year={2000}, pages={252–256} } @article{zhu_chowdhary_long_musfeldt_koo_whangbo_wei_negishi_inoue_sarrao_et al._2000, title={Polarized optical reflectance and electronic structure of the charge-density-wave materials eta- and gamma-Mo4O11}, volume={61}, DOI={10.1103/physrevb.61.10057}, number={15}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Zhu, Z. and Chowdhary, S. and Long, V. C. and Musfeldt, J. L. and Koo, H. J. and Whangbo, M. H. and Wei, X. and Negishi, H. and Inoue, M. and Sarrao, J. and et al.}, year={2000}, pages={10057–10065} } @article{koo_whangbo_2000, title={Spin dimer analysis of the spin exchange interactions of the vanadium oxides AV(4)O(9) (A = Ca, Sr, Cs-2, NH2(CH2)(4)NH2)}, volume={153}, DOI={10.1006/jssc.2000.8753}, number={2}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={2000}, pages={263–269} } @article{jung_koo_whangbo_2000, title={Study of the 18-electron band gap and ferromagnetism in semi- Heusler compounds by nea-spin-polarized electronic band structure calculations}, volume={527}, number={2000 Aug. 4}, journal={Journal of Molecular Structure [including Theochem]}, author={Jung, D. and Koo, H. J. and Whangbo, M. H.}, year={2000}, pages={113–119} } @article{jobic_brec_chateau_haines_leger_koo_whangbo_2000, title={Synthesis and crystal structure determination of a new pressure-induced iridium ditelluride phase, m-irte2, and comparison of the crystal structures and relative stabilities of various irte2 polymorphs}, volume={39}, DOI={10.1021/ic000351e}, number={19}, journal={Inorganic Chemistry}, author={Jobic, S. and Brec, R. and Chateau, C. and Haines, J. and Leger, J. M. and Koo, H. J. and Whangbo, M. H.}, year={2000}, pages={4370–4373} } @article{koo_whangbo_1999, title={Analysis of bonding and d-electron count in the transition- metal carbides and transition-metal-silicide carbides with discrete linear M-C-M units (M = Cr, Fe, Re) by electronic structure calculations}, volume={38}, DOI={10.1021/ic981309a}, number={9}, journal={Inorganic Chemistry}, author={Koo, H. J. and Whangbo, M. H.}, year={1999}, pages={2204–2210} } @article{koo_whangbo_dong_olejniczak_musfeldt_schlueter_geiser_1999, title={Analysis of polarized optical excitations by electronic band structure calculations: Organic superconductor beta ''-(BEDT- TTF)(2)SF5CH2CF2SO3}, volume={112}, DOI={10.1016/S0038-1098(99)00379-8}, number={7}, journal={Solid State Communications}, author={Koo, H. J. and Whangbo, M. H. and Dong, J. and Olejniczak, I. and Musfeldt, J. L. and Schlueter, J. A. and Geiser, U.}, year={1999}, pages={403–407} } @article{koo_whangbo_1999, title={Analysis of the spin-spin interactions in layered oxides alpha '-NaV2O5, CaV2O5 and MgV2O5 and the spin-Peierls distortion in alpha '-NaV2O5 by molecular orbital, Madelung energy and bond valence sum calculations}, volume={111}, DOI={10.1016/S0038-1098(99)00179-9}, number={7}, journal={Solid State Communications}, author={Koo, H. J. and Whangbo, M. H.}, year={1999}, pages={353–360} } @article{lee_koo_ren_whangbo_1999, title={Calculations and analysis of the electronic structures of transition-metal phosphosilicides Cu4SiP8, IrSi3P3, CoSi3P3, and FeSi4P4}, volume={147}, DOI={10.1006/jssc.1999.8142}, number={1}, journal={Journal of Solid State Chemistry}, author={Lee, K. S. and Koo, H. J. and Ren, J. and Whangbo, M. H.}, year={1999}, pages={11–18} } @article{kelty_li_chen_chianelli_ren_whangbo_1999, title={Characterization of the RuS2(100) surface by scanning tunneling microscopy, atomic force microscopy, and near-edge X-ray absorption fine structure measurements and electronic band structure calculations}, volume={103}, DOI={10.1021/jp9842594}, number={22}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Kelty, S. P. and Li, J. and Chen, J. G. and Chianelli, R. R. and Ren, J. and Whangbo, M. H.}, year={1999}, pages={4649–4655} } @article{bar_brandsch_whangbo_1999, title={Correlation between frequency-sweep hysteresis and phase imaging instability in tapping mode atomic force microscopy}, volume={436}, DOI={10.1016/S0039-6028(99)00702-5}, number={1-3}, journal={Surface Science}, author={Bar, G. and Brandsch, R. and Whangbo, M. H.}, year={1999}, pages={L715–723} } @article{schmidt_thiele_whangbo_1999, title={Determination of the Se atom distribution in the layered compound Nb-3(Se1-xIx)I-7 by scanning tunneling microscopy}, DOI={10.1002/(sici)1099-0682(199905)1999:5<785::aid-ejic785>3.0.co;2-e}, number={5}, journal={European Journal of Inorganic Chemistry}, author={Schmidt, P. J. and Thiele, G. and Whangbo, M. H.}, year={1999}, pages={785–787} } @article{schmidt_thiele_cantow_ren_whangbo_1999, title={Distribution of the Se atoms in the layered compound Nb-3(Se1- xIx)I-7 studied by scanning tunneling microscopy and electronic structure calculations}, volume={103}, DOI={10.1021/jp9843813}, number={18}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Schmidt, P. J. and Thiele, G. and Cantow, H. J. and Ren, J. Q. and Whangbo, M. H.}, year={1999}, pages={3626–3633} } @misc{bar_brandsch_whangbo_1999, title={Effect of tip sharpness on the relative contributions of attractive and repulsive forces in the phase imaging of tapping mode atomic force microscopy}, volume={422}, DOI={10.1016/s0039-6028(98)00899-1}, number={1-3}, journal={Surface Science}, author={Bar, G. and Brandsch, R. and Whangbo, M. H.}, year={1999}, pages={L192–199} } @article{lee_koo_dai_ren_whangbo_1999, title={Electron counting scheme relevant for late transition metal compounds with weakly electronegative ligands. Electronic band structure study of phosphosilicides PtSi3P2 and NiSi2P3}, volume={38}, DOI={10.1021/ic980761r}, number={2}, journal={Inorganic Chemistry}, author={Lee, K. S. and Koo, H. J. and Dai, D. and Ren, J. and Whangbo, M. H.}, year={1999}, pages={340–345} } @article{stagarescu_duda_smith_seo_whangbo_jerome_haddon_brooks_guo_nordgren_1999, title={Electronic structure of the organic conductors kappa- ET2Cu(SCN)(2) and kappa-ET2Cu[N(CN)(2)]Br studied using soft X- ray absorption and soft X-ray emission}, volume={143}, DOI={10.1006/jssc.1998.8046}, number={1}, journal={Journal of Solid State Chemistry}, author={Stagarescu, C. B. and Duda, L. C. and Smith, K. E. and Seo, D. K. and Whangbo, M. H. and Jerome, D. and Haddon, R. C. and Brooks, J. S. and Guo, J. H. and Nordgren, J.}, year={1999}, pages={1–8} } @article{whangbo_bengel_jobic_brec_1999, title={Flexibility of the MPS4- chains of the KMPS4 (M = Ni, Pd) compounds studied by molecular orbital calculations and atomic force microscopy measurements}, volume={147}, DOI={10.1006/jssc.1999.8245}, number={1}, journal={Journal of Solid State Chemistry}, author={Whangbo, M. H. and Bengel, H. and Jobic, S. and Brec, R.}, year={1999}, pages={235–239} } @article{zhu_long_musfeldt_wei_sarrao_fisk_negishi_inoue_koo_whangbo_1999, title={High field optical response of eta-Mo4O11}, volume={9}, DOI={10.1051/jp4:19991063}, number={P10}, journal={Journal de Physique. IV}, author={Zhu, Z. and Long, V. C. and Musfeldt, J. L. and Wei, X. and Sarrao, J. and Fisk, Z. and Negishi, H. and Inoue, M. and Koo, H. J. and Whangbo, M. H.}, year={1999}, pages={251–253} } @article{bar_delineau_brandsch_bruch_whangbo_1999, title={Importance of the indentation depth in tapping-mode atomic force microscopy study of compliant materials}, volume={75}, DOI={10.1063/1.125581}, number={26}, journal={Applied Physics Letters}, author={Bar, G. and Delineau, L. and Brandsch, R. and Bruch, M. and Whangbo, M. H.}, year={1999}, pages={4198–4200} } @article{wang_vanzile_schlueter_geiser_kini_sche_koo_whangbo_nixon_winter_et al._1999, title={In-plane ESR microwave conductivity measurements and electronic band structure studies of the organic superconductor beta ''- (BEDT-TTF)(2)SF5CH2CF2SO3}, volume={103}, DOI={10.1021/jp991268j}, number={26}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Wang, H. H. and Vanzile, M. L. and Schlueter, J. A. and Geiser, U. and Kini, A. M. and Sche, P. P. and Koo, H. J. and Whangbo, M. H. and Nixon, P. G. and Winter, R. W. and et al.}, year={1999}, pages={5493–5499} } @article{stagarescu_duda_smith_seo_whangbo_jerome_haddon_brooks_guo_nordgren_1999, title={Molecular components of the bulk electronic structure of organic conductors: a soft X-ray absorption and soft X-ray emission spectroscopy approach}, volume={103}, DOI={10.1016/S0368-2048(98)00346-6}, number={1999 June}, journal={Journal of Electron Spectroscopy and Related Phenomena}, author={Stagarescu, C. B. and Duda, L. C. and Smith, K. E. and Seo, D. K. and Whangbo, M. H. and Jerome, D. and Haddon, R. C. and Brooks, J. S. and Guo, J. H. and Nordgren, J.}, year={1999}, pages={539–544} } @article{long_zhu_musfeldt_wei_koo_whangbo_jegoudez_revcolevschi_1999, title={Polarized optical reflectance and electronic band structure of alpha '-NaV2O5}, volume={60}, DOI={10.1103/physrevb.60.15721}, number={23}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Long, V. C. and Zhu, Z. and Musfeldt, J. L. and Wei, X. and Koo, H. J. and Whangbo, M. H. and Jegoudez, J. and Revcolevschi, A.}, year={1999}, pages={15721–15727} } @article{lee_koo_whangbo_1999, title={Spin-spin interactions in the oxides A(3)M ' MO6 (M = Rh, Ir; A = Ca, Sr; M ' = alkaline earth, Zn, Cd, Na) of the K4CdCl6 structure type examined by electronic structure calculations}, volume={38}, DOI={10.1021/ic9813819}, number={9}, journal={Inorganic Chemistry}, author={Lee, K. S. and Koo, H. J. and Whangbo, M. H.}, year={1999}, pages={2199–2203} } @article{beckmann_wanka_wosnitza_schlueter_williams_nixon_winter_gard_ren_whangbo_1998, title={Characterization of the Fermi surface of the organic superconductor beta''-(ET)(2)SF5CH2CF2SO3 by measurements of Shubnikov-de Haas and angle-dependent magnetoresistance oscillations and by electronic band-structure calculations}, volume={1}, DOI={10.1007/s100510050185}, number={3}, journal={European Physical Journal. B, Condensed Matter Physics}, author={Beckmann, D. and Wanka, S. and Wosnitza, J. and Schlueter, J. A. and Williams, J. M. and Nixon, P. G. and Winter, R. W. and Gard, G. L. and Ren, J. and Whangbo, M. H.}, year={1998}, pages={295–300} } @article{bar_thomann_whangbo_1998, title={Characterization of the morphologies and nanostructures of blends of poly(styrene) block-poly(ethene-co-but-1-ene)-block-poly(styrene) with isotactic and atactic polypropylenes by tapping-mode atomic force microscopy}, volume={14}, DOI={10.1021/la9711544}, number={5}, journal={Langmuir}, author={Bar, G. and Thomann, Y. and Whangbo, M. H.}, year={1998}, pages={1219–1226} } @article{zhang_warren_haushalter_clearfield_seo_whangbo_1998, title={Comparative study of the structural, electronic, and magnetic properties of the layered ternary vanadium oxides CaV4O9, Cs2V4O9, and [H2N(CH2)4NH2]V4O9}, volume={10}, DOI={10.1021/cm970653n}, number={4}, journal={Chemistry of Materials}, author={Zhang, Y. P. and Warren, C. J. and Haushalter, R. C. and Clearfield, A. and Seo, D.-K. and Whangbo, M.-H.}, year={1998}, pages={1059–1064} } @article{dai_li_ren_whangbo_1998, title={Description of ligand field splitting in terms of density functional theory: Calculations of the split levels of the F-2(5/2) and F-2(7/2) subterms in CeO and CeF under the weak field coupling scheme}, volume={108}, DOI={10.1063/1.475747}, number={9}, journal={Journal of Chemical Physics}, author={Dai, D. D. and Li, L. M. and Ren, J. and Whangbo, M. H.}, year={1998}, pages={3479–3488} } @article{ren_whangbo_dai_li_1998, title={Description of ligand field splitting in terms of density functional theory: Split levels of the lowest-lying subterms of the 4f(n-1)6s(2) (n=3-14) configurations in lanthanide monofluorides LnF (Ln=Pr-Yb)}, volume={108}, DOI={10.1063/1.476276}, number={20}, journal={Journal of Chemical Physics}, author={Ren, J and Whangbo, M. H. and Dai, D. D. and Li, L. M}, year={1998}, pages={8479–8484} } @misc{whangbo_bar_brandsch_1998, title={Description of phase imaging in tapping mode atomic force microscoby harmonic approximation}, volume={411}, DOI={10.1016/s0039-6028(98)00349-5}, number={1-2}, journal={Surface Science}, author={Whangbo, M. H. and Bar, G. and Brandsch, R.}, year={1998}, pages={L794–801} } @misc{bar_brandsch_whangbo_1998, title={Description of the frequency dependence of the amplitude and phase angle of a silicon cantilever tapping on a silicon substrate by the harmonic approximation}, volume={411}, DOI={10.1016/s0039-6028(98)00348-3}, number={1-2}, journal={Surface Science}, author={Bar, G. and Brandsch, R. and Whangbo, M. H.}, year={1998}, pages={L802–809} } @misc{bar_brandsch_whangbo_1998, title={Effect of viscoelastic properties of polymers on the phaseshift in tapping mode atomic force microscopy}, volume={14}, DOI={10.1021/la980969p}, number={26}, journal={Langmuir}, author={Bar, G. and Brandsch, R. and Whangbo, M. H.}, year={1998}, pages={7343–7348} } @article{thomann_cantow_bar_whangbo_1998, title={Investigation of morphologies and nanostructures of polymer blends by tapping mode phase imaging}, volume={66}, DOI={10.1007/s003390051333}, number={1998 Mar.}, journal={Applied Physics. A, Materials Science & Processing (Online)}, author={Thomann, Y. and Cantow, H. J. and Bar, G. and Whangbo, M. H.}, year={1998}, pages={S1233–1236} } @article{koo_whangbo_mccarroll_greenblatt_gautier_halet_gougeon_1998, title={On the origin of the anomalous electrical resistivity of LnMo(5)O(8) (Ln = trivalent rare earth)}, volume={108}, DOI={10.1016/S0038-1098(98)00407-4}, number={8}, journal={Solid State Communications}, author={Koo, H. J. and Whangbo, M. H. and McCarroll, W. H. and Greenblatt, M. and Gautier, R. and Halet, J. F. and Gougeon, P.}, year={1998}, pages={539–544} } @article{seo_gupta_whangbo_hillebrecht_thiele_1998, title={Pressure-induced changes in the structure and band gap of CsGeX3 (X = Cl, Br) studied by electronic band structure calculations}, volume={37}, DOI={10.1021/ic970659e}, number={3}, journal={Inorganic Chemistry}, author={Seo, D. K. and Gupta, N. and Whangbo, M. H. and Hillebrecht, H. and Thiele, G.}, year={1998}, pages={407–410} } @article{whangbo_bar_brandsch_1998, title={Qualitative relationships describing height and phase images of tapping mode atomic force microscopy. An application to micro-contact-printed patterned self-assembled monolayers}, volume={66}, DOI={10.1007/s003390051340}, number={1998 Mar.}, journal={Applied Physics. A, Materials Science & Processing (Online)}, author={Whangbo, M. H. and Bar, G. and Brandsch, R.}, year={1998}, pages={S1267–1270} } @article{bengel_jobic_deudon_rouxel_seo_whangbo_1998, title={Scanning tunneling and atomic force microscopy study of the misfit layer compounds (LaS)1.14(NbS2)n (n=1,2) and [(Pb,Sb)S)]1.14NbS2}, volume={400}, DOI={10.1016/S0039-6028(97)00882-0}, number={1-3}, journal={Surface Science}, author={Bengel, H. and Jobic, S. and Deudon, C. and Rouxel, J. and Seo, D.-K. and Whangbo, M.-H.}, year={1998}, pages={266–276} } @article{koo_whangbo_kennedy_1998, title={Similarities and differences in the structural and electronic properties of ruthenium and iridium pyrochlores A(2)M(2)O(7-y) (M = Ru, Ir)}, volume={136}, DOI={10.1006/jssc.1997.7705}, number={2}, journal={Journal of Solid State Chemistry}, author={Koo, H. J. and Whangbo, M. H. and Kennedy, B. J.}, year={1998}, pages={269–273} } @article{ogawa_irie_isoda_kobayashi_whangbo_1998, title={Simulation of long-range contrast modulation in scanning tunneling microscope image of perylene-3,4,9,10- tetracarboxylic-dianhydride monolayer on graphite}, volume={37}, DOI={10.1143/JJAP.37.3864}, number={6B}, journal={Japanese Journal of Applied Physics. Part 1, Regular Papers, Short Notes & Review Papers}, author={Ogawa, T. and Irie, S. and Isoda, S. and Kobayashi, T. and Whangbo, M. H.}, year={1998}, pages={3864–3866} } @article{jung_seo_ren_whangbo_1998, title={Simulation of the scanning tunneling and atomic force microscopy images of a xanthine monolayer on graphite}, volume={401}, DOI={10.1016/S0039-6028(98)00069-7}, number={3}, journal={Surface Science}, author={Jung, D. and Seo, D. K. and Ren, J. and Whangbo, M. H.}, year={1998}, pages={476–481} } @article{seo_whangbo_neininger_g._1998, title={Single-crystal X-ray diffraction and electronic band structure studies of PdTeI}, volume={137}, DOI={10.1006/jssc.1997.7669}, number={2}, journal={Journal of Solid State Chemistry}, author={Seo, D. K. and Whangbo, M. H. and Neininger, K. and G., Thiele}, year={1998}, pages={206–210} } @article{wang_haushalter_whangbo_1998, title={Synthesis, characterization, and electronic structure analysis of (Et4N)(4)KAuAs4Te8 and electron counting for the zintl anion containing a square-planar AuTe4 unit}, volume={37}, DOI={10.1021/ic980389f}, number={23}, journal={Inorganic Chemistry}, author={Wang, C. and Haushalter, R. C. and Whangbo, M. H.}, year={1998}, pages={6096–6099} } @article{kuo_skove_verebelyi_li_mackay_hwu_whangbo_brill_1998, title={Unusual physical properties of KCu7-xS4 at diffusive one-dimensional ordering transitions}, volume={57}, DOI={10.1103/physrevb.57.3315}, number={6}, journal={Physical Review. B, Condensed Matter and Materials Physics}, author={Kuo, Y. K. and Skove, M. J. and Verebelyi, D. T. and Li, H. and Mackay, R. and Hwu, S. J. and Whangbo, M. H. and Brill, J. W.}, year={1998}, pages={3315–3325} } @article{hess_schlenker_dumas_greenblatt_canadell_whangbo_1997, title={Anisotropic thermopower in the charge density wave quasi two-dimensional compounds (po2)(4)(wo3)(2m)(m=4, 6)}, volume={86}, DOI={10.1016/S0379-6779(97)81090-9}, number={1-3}, journal={Synthetic Metals}, author={Hess, C. and Schlenker, C. and Dumas, J. and Greenblatt, M. and Canadell, E. and Whangbo, M.-H.}, year={1997}, pages={2189–2190} } @article{wang_fox_yagubskii_kushch_kotov_whangbo_1997, title={Direct observation of the electron-donating property of the 5,6-dihydro-1,4-dithiin-2,3-dithiolate (DDDT) ligands in square planar m(DDDT)2 complexes (m=Ni, Pd, Pt, and Au)}, volume={119}, DOI={10.1021/ja9704747}, number={32}, journal={Journal of the American Chemical Society}, author={Wang, H. H. and Fox, S. B. and Yagubskii, E. B. and Kushch, L. A. and Kotov, A. I. and Whangbo, M.-H.}, year={1997}, pages={7601–7602} } @article{seo_whangbo_subramanian_1997, title={Electronic band structure study of colossal magnetoresistance in Tl2Mn2O7}, volume={101}, DOI={10.1016/S0038-1098(96)00622-9}, number={6}, journal={Solid State Communications}, author={Seo, D. K. and Whangbo, M.-H. and Subramanian, M. A.}, year={1997}, pages={417–421} } @article{lee_seo_whangbo_1997, title={Electronic band structure study of the anomalous electrical and superconducting properties of hexagonal alkali tungsten bronzes A(x)Wo(3) (A=K, Rb, Cs)}, volume={119}, DOI={10.1021/ja964455t}, number={17}, journal={Journal of the American Chemical Society}, author={Lee, K. S. and Seo, D. K. and Whangbo, M.-H.}, year={1997}, pages={4043–4049} } @article{seo_ren_whangbo_canadell_1997, title={Electronic band structure study of the transport properties of the intermetallic compounds ZrRuP and ZrRuSi}, volume={36}, DOI={10.1021/ic970148s}, number={26}, journal={Inorganic Chemistry}, author={Seo, D. K. and Ren, J. Q. and Whangbo, M. H. and Canadell, E.}, year={1997}, pages={6058–6063} } @article{greenblatt_zhang_whangbo_1997, title={Electronic properties of La(3)Ni(2)O(7) and Ln(4)Ni(3)O(10), Ln=La, Pr and Nd}, volume={85}, DOI={10.1016/S0379-6779(97)80312-8}, number={1-3}, journal={Synthetic Metals}, author={Greenblatt, M. and Zhang, Z. and Whangbo, M.-H.}, year={1997}, pages={1451–1452} } @article{bar_thomann_brandsch_cantow_whangbo_1997, title={Factors affecting the height and phase images in tapping mode atomic force microscopy. Study of phase-separated polymer blends of poly(ethene-co-styrene) and poly(2,6-dimethyl-1,4-}, volume={13}, DOI={10.1021/la970091m}, number={14}, journal={Langmuir}, author={Bar, G. and Thomann, Y. and Brandsch, R. and Cantow, H. J. and Whangbo, M. H.}, year={1997}, pages={3807–3812} } @article{shreeve_haushalter_lee_sichu_o'connor_seo_whangbo_1997, title={New layered materials in the K-In-Ge-As system: K8In8Ge5As17 and K5In5Ge5As14}, volume={130}, DOI={10.1006/jssc.1996.7210}, number={2}, journal={Journal of Solid State Chemistry}, author={Shreeve, Keyer J. L. and Haushalter, R. C. and Lee, Y.-S. and Sichu, L. I. and O'Connor, C. J. and Seo, D.-K. and Whangbo, M.-H.}, year={1997}, pages={234–249} } @article{brandsch_bar_whangbo_1997, title={On the factors affecting the contrast of height and phase images in tapping mode atomic force microscopy}, volume={13}, DOI={10.1021/la970822i}, number={24}, journal={Langmuir}, author={Brandsch, R. and Bar, G. and Whangbo, M.-H.}, year={1997}, pages={6349–6353} } @article{dhingra_1997, title={One dimensional semiconducting chains of the Quaternary ZiNTl anion in (Et(4)N)(4)[Au((Ag(1- x)Au(x))(2)Sn(2)Te(9)]}, volume={36}, DOI={10.1002/anie.199710871}, number={10}, journal={Angewandte Chemie [International Edition in English]}, author={Dhingra, S.}, year={1997}, pages={1087–1090} } @article{gupta_seo_whangbo_jobic_rouxel_brec_1997, title={Square planar to rectangular distortion in transition-metal compounds of edge-sharing square planar units MX(4)}, volume={128}, DOI={10.1006/jssc.1996.7177}, number={2}, journal={Journal of Solid State Chemistry}, author={Gupta, N. and Seo, D.-K. and Whangbo, M.-H. and Jobic, S. and Rouxel, J. and Brec, R.}, year={1997}, pages={181–184} } @misc{lee_seo_whangbo_1997, title={Structural and electronic factors governing the metallic and nonmetallic properties of the pyrochlores A2Ru2O7-Y}, volume={131}, DOI={10.1006/jssc.1997.7497}, number={2}, journal={Journal of Solid State Chemistry}, author={Lee, K. S. and Seo, D. K. and Whangbo, M.-H.}, year={1997}, pages={405–408} } @article{hillebrecht_schmidt_rotter_thiele_zonnchen_bengel_cantow_magonov_whangbo_1997, title={Structural and scanning microscopy studies of layered compounds MCl(3) (M=Mo, Ru, Cr) and MOCl(2) (M=V, Nb, Mo, Ru, Os)}, volume={246}, DOI={10.1016/S0925-8388(96)02465-6}, number={1-2}, journal={Journal of Alloys and Compounds}, author={Hillebrecht, H. and Schmidt, P. J. and Rotter, H. W. and Thiele, G. and Zonnchen, P. and Bengel, H. and Cantow, H. J. and Magonov, S. N. and Whangbo, M.-H.}, year={1997}, pages={70–79} } @article{seo_perdue_ren_whangbo_1997, title={Study of scanning tunneling microscopy images and probable relaxations of the SrTiO3(100) surface by electronic structure calculations}, volume={370}, DOI={10.1016/S0039-6028(97)80003-9}, number={2-3}, journal={Surface Science}, author={Seo, D. K. and Perdue, K. and Ren, J.-Q. and Whangbo, M.-H.}, year={1997}, pages={245–251} } @article{seo_ren_whangbo_1997, title={Study of the origin of superstructure patterns in the scanning tunneling images of perylene 3,4,9,10 tetracarboxylic dianhydride on graphite by electronic structure calculations}, volume={370}, DOI={10.1016/S0039-6028(96)00948-X}, number={2-3}, journal={Surface Science}, author={Seo, D. K. and Ren, J.-Q. and Whangbo, M.-H.}, year={1997}, pages={252–258} } @article{seo_whangbo_1997, title={Symmetric stretching vibrations of two-coordinate oxygen bridges as a cause for negative thermal expansion in zrv(x)p(2)-(x)o(7) and aw(2)o(8) (a=zr, hf) at high temperature}, volume={129}, DOI={10.1006/jssc.1997.7301}, number={1}, journal={Journal of Solid State Chemistry}, author={Seo, D. K. and Whangbo, M.-H.}, year={1997}, pages={160–163} } @article{magonov_cleveland_elings_denley_whangbo_1997, title={Tapping-mode atomic force microscopy study of the near-surface composition of a styrene-butadiene-styrene triblock copolymer film}, volume={389}, DOI={10.1016/S0039-6028(97)00412-3}, number={1-3}, journal={Surface Science}, author={Magonov, S. N. and Cleveland, J. and Elings, V. and Denley, D. and Whangbo, M.-H.}, year={1997}, pages={201–211} } @article{lee_seo_whangbo_li_mackay_hwu_1997, title={Vacancy ordering as the cause for the electrical resistivity anomalies and superlattice modulations in ACu(7-x)S(4) (A = Tl, K, Rb)}, volume={134}, DOI={10.1006/jssc.1997.7506}, number={1}, journal={Journal of Solid State Chemistry}, author={Lee, K. S. and Seo, D. K. and Whangbo, M. H. and Li, H. and Mackay, R. and Hwu, S. 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