Erjun Kan Zhang, Y., Kan, E., & Whangbo, M.-H. (2011). Density Functional Investigation of the Difference in the Magnetic Structures of the Layered Triangular Antiferromagnets CuFeO2 and AgCrO2. CHEMISTRY OF MATERIALS, 23(18), 4181–4185. https://doi.org/10.1021/cm2011567 Zhang, Y., Kan, E., Xiang, H., Villesuzanne, A., & Whangbo, M.-H. (2011). 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). INORGANIC CHEMISTRY, 50(5), 1758–1766. https://doi.org/10.1021/ic1022278 Xiang, H. J., Kan, E. J., Whangbo, M.-H., Lee, C., Wei, S.-H., & Gong, X. G. (2011). Single-ion anisotropy, Dzyaloshinskii-Moriya interaction, and negative magnetoresistance the spin-1/2 pyrochlore R2V2O7. PHYSICAL REVIEW B, 83(17). https://doi.org/10.1103/physrevb.83.174402 Lee, C., Kan, E. J., Whangbo, M.-H., Bussmann-Holder, A., & Simon, A. (2012). Spin/Charge Redistributions and Oxygen Atom Displacements Induced by Spin Flip and Hole Doping in the CuO2 Layer of High-Temperature Superconductors. JOURNAL OF SUPERCONDUCTIVITY AND NOVEL MAGNETISM, 25(1), 55–59. https://doi.org/10.1007/s10948-011-1208-3 Tian, C., Lee, C., Kan, E., Wu, F., & Whangbo, M.-H. (2010). Analysis of the Magnetic Structure and Ferroelectric Polarization of Monoclinic MnSb2S4 by Density Functional Theory Calculations. INORGANIC CHEMISTRY, 49(23), 10956–10959. https://doi.org/10.1021/ic101351b Kan, E., Xiang, H. J., Wu, F., Lee, C., Yang, J. L., & Whangbo, M. H. (2010). Ferrimagnetism in zigzag graphene nanoribbons induced by main-group adatoms. Applied Physics Letters, 96(10). Kan, E., Xiang, H., Lee, C., Wu, F., Yang, J., & Whangbo, M.-H. (2010). Ferroelectricity in Perovskites with s(0) A-Site Cations: Toward Near-Room-Temperature Multiferroics. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 49(9), 1603–1606. https://doi.org/10.1002/anie.200905997 Dorolti, E., Cario, L., Corraze, B., Janod, E., Vaju, C., Koo, H.-J., … Whangbo, M.-H. (2010). Half-Metallic Ferromagnetism and Large Negative Magnetoresistance in the New Lacunar Spinel GaTi3VS8. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 132(16), 5704–5710. https://doi.org/10.1021/ja908128b Wu, F., Kan, E., & Whangbo, M.-H. (2010). On the Importance of the Interplaquette Spin Exchanges in Na3RuO4: Density Functional Theory Analysis of the Spin Exchange and Magnetic Properties. INORGANIC CHEMISTRY, 49(6), 3025–3028. https://doi.org/10.1021/ic902568v Ji, S., Kan, E. J., Whangbo, M.-H., Kim, J.-H., Qiu, Y., Matsuda, M., … Lee, S.-H. (2010). Orbital order and partial electronic delocalization in a triangular magnetic metal Ag2MnO2. PHYSICAL REVIEW B, 81(9). https://doi.org/10.1103/physrevb.81.094421 Kan, E. J., Xiang, H. J., Wu, F., Tian, C., Lee, C., Yang, J. L., & Whangbo, M. H. (2010). Prediction for room-temperature half-metallic ferromagnetism in the half-fluorinated single layers of BN and ZnO. Applied Physics Letters, 97(12). Tong, J. W., Kremer, R. K., Kohler, J., Simon, A., Lee, C. H., Kan, E., & Whangbo, M. H. (2010). The layered ferromagnet Cs2AgF4: Antiferromagnetic inter-layer coupling driven by magnetic dipole-dipole interactions. Zeitschrift fur Kristallographie, 225(11), 498–503. Wu, F., Kan, E., Tian, C., & Whangbo, M.-H. (2010). Theoretical Analysis of the Spin Exchange and Magnetic Dipole-Dipole Interactions Leading to the Magnetic Structure of Ni3TeO6. INORGANIC CHEMISTRY, 49(16), 7545–7548. https://doi.org/10.1021/ic101022f Lee, C., Kan, E., Xiang, H., & Whangbo, M.-H. (2010). Theoretical Investigation of the Magnetic Structure and Ferroelectric Polarization of the Multiferroic Langasite Ba3NbFe3Si2O14. CHEMISTRY OF MATERIALS, 22(18), 5290–5295. https://doi.org/10.1021/cm101441p Xiang, H. J., Kan, E. J., Wei, S.-H., Gong, X. G., & Whangbo, M.-H. (2010). Thermodynamically stable single-side hydrogenated graphene. PHYSICAL REVIEW B, 82(16). https://doi.org/10.1103/physrevb.82.165425 Tian, C., Kan, E., Lee, C., & Whangbo, M.-H. (2010). pi-Back-Donation Effect of the Cyanide Ligands on the Electron Correlation and Charge Transfer in Prussian Blue RbMn[Fe(CN)(6)]. INORGANIC CHEMISTRY, 49(7), 3086–3088. https://doi.org/10.1021/ic902577r Xiang, H., Kan, E., Wei, S.-H., Whangbo, M.-H., & Yang, J. (2009). "Narrow" Graphene Nanoribbons Made Easier by Partial Hydrogenation. NANO LETTERS, 9(12), 4025–4030. https://doi.org/10.1021/nl902198u Kan, E. J., Xiang, H. J., Zhang, Y., Lee, C., & Whangbo, M.-H. (2009). Density-functional analysis of spin exchange and ferroelectric polarization in AgCrO2. PHYSICAL REVIEW B, 80(10). https://doi.org/10.1103/physrevb.80.104417 Wu, F., Kan, E. J., Xiang, H. J., Wei, S. H., Whangbo, M. H., & Yang, J. L. (2009). Magnetic states of zigzag graphene nanoribbons from first principles. Applied Physics Letters, 94(22). Kan, E. J., Xiang, H. J., Yang, J. L., & Whangbo, M. H. (2009). Magnetism of semiconductor-based magnetic tunnel junctions under electric field from first principles. Applied Physics Letters, 94(25). Xiang, H. J., Kan, E. J., Wei, S.-H., Whangbo, M.-H., & Yang, J. (2009). Origin of the Ising ferrimagnetism and spin-charge coupling in LuFe2O4. PHYSICAL REVIEW B, 80(13). https://doi.org/10.1103/physrevb.80.132408