@article{han_sommer_boyle_zhou_young_borodin_henderson_2022, title={Electrolyte Solvation and Ionic Association: Part IX. Structures and Raman Spectroscopic Characterization of LiFSI Solvates}, volume={169}, ISSN={["1945-7111"]}, url={https://doi.org/10.1149/1945-7111/ac9a07}, DOI={10.1149/1945-7111/ac9a07}, abstractNote={ The bis(fluorosulfonyl)imide anion N(SO2F)2- (i.e., FSI-) (also referred to as bis(fluorosulfonyl)amide (i.e., FSA-) and imidodi(sulphuryl fluoride)) has attracted tremendous interest in recent years for its utility in both lithium salts and ionic liquids for battery electrolyte applications. To facilitate the understanding of the characteristics of this anion, crystal structures are reported here for the uncoordinated anion in LiFSI-based solvates with cryptand CRYPT-222 and tetraglyme (G4). These crystalline solvates were analyzed by Raman spectroscopy to aid in assigning the Raman bands to the modes of ion coordination found in liquid electrolytes. These structures, as well as a thorough review of other relevant crystallographic data, provide insights into the rather remarkable properties of the FSI- anion with regard to solvate formation and electrolyte properties.}, number={11}, journal={JOURNAL OF THE ELECTROCHEMICAL SOCIETY}, author={Han, Sang-Don and Sommer, Roger D. and Boyle, Paul D. and Zhou, Zhi-Bin and Young, Victor G. and Borodin, Oleg and Henderson, Wesley A.}, year={2022}, month={Nov} } @article{henderson_helm_seo_trulove_de long_borodin_2022, title={Electrolyte Solvation and Ionic Association: Reassessing Raman Spectroscopic Studies of Ion Coordination for LiTFS}, volume={169}, ISSN={["1945-7111"]}, DOI={10.1149/1945-7111/ac71d4}, abstractNote={ Raman spectroscopy is widely used to evaluate the ionic interactions and solvates present in electrolytes. As shown here, however, Raman spectra for crystalline solvates containing the lithium bis(trifluoromethanesulfonyl)imide (or amide) (i.e., LiN(SO2CF3)2, LiTFSI, LiTFSA, LiNTf2 or LiTf2N) salt indicate that the commonly used vibrational band analyses are likely to be inaccurate and thus result in misleading conclusions about the ion interactions in liquid electrolytes with this salt. In particular, it is found by examining the Raman spectrum of a known crystalline solvate with the CIP-I-C2 coordination mode (i.e., a TFSI- anion with a C2 conformation coordinated to a single Li+ cation via a single oxygen atoms), that the vibrational band for this mode of coordination overlaps (or is closely positioned beside) that for the uncoordinated (i.e., SSIP) TFSI- anion. This realization further complicates the assessment of Raman data for LiTFSI-based electrolytes.}, number={6}, journal={JOURNAL OF THE ELECTROCHEMICAL SOCIETY}, author={Henderson, Wesley A. and Helm, Monte L. and Seo, Daniel M. and Trulove, Paul C. and De Long, Hugh C. and Borodin, Oleg}, year={2022}, month={Jun} } @article{daubert_afroz_borodin_seo_boyle_henderson_2022, title={Solvate Structures and Computational/Spectroscopic Characterization of LiClO4 Electrolytes}, ISSN={["1932-7455"]}, DOI={10.1021/acs.jpcc.2c03805}, abstractNote={A Raman spectral evaluation of numerous crystalline solvates with lithium perchlorate (LiClO4) has been conducted over a wide temperature range. Two new solvate crystal structures─(PMDETA)1:LiClO4 and (THF)1:LiClO4 with N,N,N′,N″,N″-pentamethyldiethylenetriamine and tetrahydrofuran─have been determined to aid in this study. With a help of density functional theory (DFT) and molecular dynamics (MD) simulations, the spectroscopic data have been correlated with varying modes of ClO4–···Li+ cation coordination within the solvate structures to create a characterization tool to facilitate the Raman band assignments for the determination of ionic association interactions within solid and liquid electrolytes containing LiClO4. This study demonstrates that many of the spectroscopic evaluation conclusions reported in the scientific literature for LiClO4-based electrolytes are inaccurate.}, journal={JOURNAL OF PHYSICAL CHEMISTRY C}, author={Daubert, James S. and Afroz, Taliman and Borodin, Oleg and Seo, Daniel M. and Boyle, Paul D. and Henderson, Wesley A.}, year={2022}, month={Aug} } @article{borodin_han_daubert_seo_yun_henderson_2015, title={Electrolyte solvation and ionic association VI. acetonitrile-lithium salt mixtures: Highly associated salts revisited}, volume={162}, number={4}, journal={Journal of the Electrochemical Society}, author={Borodin, O. and Han, S. D. and Daubert, J. S. and Seo, D. M. and Yun, S. H. and Henderson, W. A.}, year={2015}, pages={A501–510} } @article{han_yun_borodin_seo_sommer_young_henderson_2015, title={Solvate structures and computational/spectroscopic characterization of LiPF6 electrolytes}, volume={119}, number={16}, journal={Journal of Physical Chemistry. C}, author={Han, S. D. and Yun, S. H. and Borodin, O. and Seo, D. M. and Sommer, R. D. and Young, V. G. and Henderson, W. A.}, year={2015}, pages={8492–8500} } @article{afroz_seo_han_boyle_henderson_2015, title={Structural Interactions within Lithium Salt Solvates: Acyclic Carbonates and Esters}, volume={119}, ISSN={["1932-7447"]}, DOI={10.1021/acs.jpcc.5b00309}, abstractNote={Solvate crystal structures serve as useful models for the molecular-level interactions within the diverse solvates present in liquid electrolytes. Although acyclic carbonate solvents are widely used for Li-ion battery electrolytes, only three solvate crystal structures with lithium salts are known for these and related solvents. The present work, therefore, reports six lithium salt solvate structures with dimethyl and diethyl carbonate, (DMC)2:LiPF6, (DMC)1:LiCF3SO3, (DMC)1/4:LiBF4, (DEC)2:LiClO4, (DEC)1:LiClO4, and (DEC)1:LiCF3SO3 and four with the structurally related methyl and ethyl acetate, (MA)2:LiClO4, (MA)1:LiBF4, (EA)1:LiClO4, and (EA)1:LiBF4.}, number={13}, journal={JOURNAL OF PHYSICAL CHEMISTRY C}, author={Afroz, Taliman and Seo, Daniel M. and Han, Sang-Don and Boyle, Paul D. and Henderson, Wesley A.}, year={2015}, month={Apr}, pages={7022–7027} } @article{scheers_lim_kim_paillard_henderson_johansson_ahn_jacobsson_2014, title={All fluorine-free lithium battery electrolytes}, volume={251}, journal={Journal of Power Sources}, author={Scheers, J. and Lim, D. H. and Kim, J. K. and Paillard, E. and Henderson, W. A. and Johansson, P. and Ahn, J. H. and Jacobsson, P.}, year={2014}, pages={451–458} } @article{mcowen_delp_paillard_herriot_han_boyle_sommer_henderson_2014, title={Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI}, volume={118}, ISSN={["1932-7447"]}, DOI={10.1021/jp412601x}, abstractNote={Lithium 4,5-dicyano-1,2,3-triazolate (LiDCTA) and lithium 2-trifluoromethyl-4,5-dicyanoimidazole (LiTDI) are two salts proposed for lithium battery electrolyte applications, but little is known about the manner in which the DCTA– and TDI– anions coordinate Li+ cations. To explore this in depth, crystal structures are reported here for two solvates with LiDCTA—(G2)1:LiDCTA and (G1)1:LiDCTA—with diglyme and monoglyme, respectively; and seven solvates with LiTDI—(G1)2:LiTDI, (G2)2:LiTDI, (G3)1:LiTDI, (THF)1:LiTDI, (EC)1:LiTDI, (PC)1:LiTDI, and (DMC)1/2:LiTDI—with monoglyme, diglyme, triglyme, tetrahydrofuran, ethylene carbonate, propylene carbonate, and dimethyl carbonate, respectively. These latter solvate structures are compared with the previously reported acetonitrile (AN)2:LiTDI structure. The solvates indicate that the LiTDI salt is much less associated than the LiDCTA salt and that the ions in LiTDI, when aggregated in solvates, have a very similar TDI–···Li+ cation mode of coordination through both t...}, number={15}, journal={JOURNAL OF PHYSICAL CHEMISTRY C}, publisher={American Chemical Society (ACS)}, author={McOwen, Dennis W. and Delp, Samuel A. and Paillard, Elie and Herriot, Cristelle and Han, Sang-Don and Boyle, Paul D. and Sommer, Roger D. and Henderson, Wesley A.}, year={2014}, month={Apr}, pages={7781–7787} } @article{allen_borodin_seo_henderson_2014, title={Combined quantum chemical/Raman spectroscopic analyses of Li+ cation solvation: Cyclic carbonate solvents-Ethylene carbonate and propylene carbonate}, volume={267}, journal={Journal of Power Sources}, author={Allen, J. L. and Borodin, O. and Seo, D. M. and Henderson, W. A.}, year={2014}, pages={821–830} } @article{mcowen_seo_borodin_vatamanu_boyle_henderson_2014, title={Concentrated electrolytes: decrypting electrolyte properties and reassessing Al corrosion mechanisms}, volume={7}, ISSN={["1754-5706"]}, DOI={10.1039/c3ee42351d}, abstractNote={Highly concentrated electrolytes containing carbonate solvents with lithium bis(trifluoromethanesulfonyl)imide (LiTFSI) have been investigated to determine the influence of eliminating bulk solvent (i.e., uncoordinated to a Li+ cation) on electrolyte properties. The phase behavior of ethylene carbonate (EC)–LiTFSI mixtures indicates that two crystalline solvates form—(EC)3:LiTFSI and (EC)1:LiTFSI. Crystal structures for these were determined to obtain insight into the ion and solvent coordination. Between these compositions, however, a crystallinity gap exists. A Raman spectroscopic analysis of the EC solvent bands for the 3–1 and 2–1 EC–LiTFSI liquid electrolytes indicates that ∼86 and 95%, respectively, of the solvent is coordinated to the Li+ cations. This extensive coordination results in significantly improved anodic oxidation and thermal stabilities as compared with more dilute (i.e., 1 M) electrolytes. Further, while dilute EC–LiTFSI electrolytes extensively corrode the Al current collector at high potential, the concentrated electrolytes do not. A new mechanism for electrolyte corrosion of Al in Li-ion batteries is proposed to explain this. Although the ionic conductivity of concentrated EC–LiTFSI electrolytes is somewhat low relative to the current state-of-the-art electrolyte formulations used in commercial Li-ion batteries, using an EC–diethyl carbonate (DEC) mixed solvent instead of pure EC markedly improves the conductivity.}, number={1}, journal={ENERGY & ENVIRONMENTAL SCIENCE}, author={McOwen, Dennis W. and Seo, Daniel M. and Borodin, Oleg and Vatamanu, Jenet and Boyle, Paul D. and Henderson, Wesley A.}, year={2014}, month={Jan}, pages={416–426} } @article{han_borodin_seo_zhou_henderson_2014, title={Electrolyte solvation and ionic association V. acetonitrile-lithium Bis(fluorosulfonyl)imide (LiFSI) mixtures}, volume={161}, number={14}, journal={Journal of the Electrochemical Society}, author={Han, S. D. and Borodin, O. and Seo, D. M. and Zhou, Z. B. and Henderson, W. A.}, year={2014}, pages={A2042–2053} } @article{geng_henderson_2014, title={Impact of non-solvents on the structural features and enzymatic digestibility of cellulose regenerated from an ionic liquid}, volume={4}, number={59}, journal={RSC Advances}, author={Geng, X. L. and Henderson, W. A.}, year={2014}, pages={31226–31229} } @article{achinivu_howard_li_gracz_henderson_2014, title={Lignin extraction from biomass with protic ionic liquids}, volume={16}, ISSN={["1463-9270"]}, DOI={10.1039/c3gc42306a}, abstractNote={A highly effective method has been developed for the simple extraction of lignin from lignocellulosic biomass using a potentially inexpensive protic ionic liquid (PIL). After the lignin-extraction step, the PIL is easily recovered using distillation leaving the separated lignin and cellulose-rich residues available for further processing. Biopolymer solubility tests indicate that increasing the xylan (i.e., hemicellulose) solubility in the PIL results in greater fiber disruption/penetration, which significantly enhances the effectiveness of the lignin extraction.}, number={3}, journal={GREEN CHEMISTRY}, author={Achinivu, Ezinne C. and Howard, Reagan M. and Li, Guoqing and Gracz, Hanna and Henderson, Wesley A.}, year={2014}, pages={1114–1119} } @article{seo_boyle_allen_han_jonsson_johansson_henderson_2014, title={Solvate Structures and Computational/Spectroscopic Characterization of LiBF4 Electrolytes}, volume={118}, ISSN={["1932-7455"]}, DOI={10.1021/jp5046782}, abstractNote={Crystal structures have been determined for both LiBF4 and HBF4 solvates: (acetonitrile)2:LiBF4, (ethylene glycol diethyl ether)1:LiBF4, (diethylene glycol diethyl ether)1:LiBF4, (tetrahydrofuran)1:LiBF4, (methyl methoxyacetate)1:LiBF4, (succinonitrile)1:LiBF4, (N,N,N′,N″,N″-pentamethyldiethylenetriamine)1:HBF4, (N,N,N′,N′-tetramethylethylenediamine)3/2:HBF4, and (phenanthroline)2:HBF4. These, as well as other known LiBF4 solvate structures, have been characterized by Raman vibrational spectroscopy to unambiguously assign the anion Raman band positions to specific forms of BF4–···Li+ cation coordination. In addition, complementary DFT calculations of BF4–···Li+ cation complexes have provided additional insight into the challenges associated with accurately interpreting the anion interactions from experimental Raman spectra. This information provides a crucial tool for the characterization of the ionic association interactions within electrolytes.}, number={32}, journal={JOURNAL OF PHYSICAL CHEMISTRY C}, author={Seo, Daniel M. and Boyle, Paul D. and Allen, Joshua L. and Han, Sang-Don and Jonsson, Erlendur and Johansson, Patrik and Henderson, Wesley A.}, year={2014}, month={Aug}, pages={18377–18386} } @article{seo_boyle_sommer_daubert_borodin_henderson_2014, title={Solvate Structures and Spectroscopic Characterization of LiTFSI Electrolytes}, volume={118}, ISSN={["1520-6106"]}, DOI={10.1021/jp505006x}, abstractNote={A Raman spectroscopic evaluation of numerous crystalline solvates with lithium bis(trifluoromethanesulfonyl)imide (LiTFSI or LiN(SO2CF3)2) has been conducted over a wide temperature range. Four new crystalline solvate structures-(PHEN)3:LiTFSI, (2,9-DMPHEN)2:LiTFSI, (G3)1:LiTFSI and (2,6-DMPy)1/2:LiTFSI with phenanthroline, 2,9-dimethyl[1,10]phenanthroline, triglyme, and 2,6-dimethylpyridine, respectively-have been determined to aid in this study. The spectroscopic data have been correlated with varying modes of TFSI(-)···Li(+) cation coordination within the solvate structures to create an electrolyte characterization tool to facilitate the Raman band deconvolution assignments for the determination of ionic association interactions within electrolytes containing LiTFSI. It is found, however, that significant difficulties may be encountered when identifying the distributions of specific forms of TFSI(-) anion coordination present in liquid electrolyte mixtures due to the wide range of TFSI(-)···Li(+) cation interactions possible and the overlap of the corresponding spectroscopic data signatures.}, number={47}, journal={JOURNAL OF PHYSICAL CHEMISTRY B}, publisher={American Chemical Society (ACS)}, author={Seo, Daniel M. and Boyle, Paul D. and Sommer, Roger D. and Daubert, James S. and Borodin, Oleg and Henderson, Wesley A.}, year={2014}, month={Nov}, pages={13601–13608} } @article{seo_borodin_balogh_o'connell_ly_han_passerini_henderson_2013, title={Electrolyte solvation and ionic association III. Acetonitrile-lithium salt mixtures-transport properties}, volume={160}, number={8}, journal={Journal of the Electrochemical Society}, author={Seo, D. M. and Borodin, O. and Balogh, D. and O'Connell, M. and Ly, Q. and Han, S. D. and Passerini, S. and Henderson, W. A.}, year={2013}, pages={A1061–1070} } @article{han_borodin_allen_seo_mcowen_yun_henderson_2013, title={Electrolyte solvation and ionic association IV. Acetonitrile-lithium difluoro(oxalato)borate (LiDFOB) mixtures}, volume={160}, number={11}, journal={Journal of the Electrochemical Society}, author={Han, S. D. and Borodin, O. and Allen, J. L. and Seo, D. M. and McOwen, D. W. and Yun, S. H. and Henderson, W. A.}, year={2013}, pages={A2100–2110} } @inproceedings{seo_allen_gardner_han_boyle_henderson_2013, title={Electrolyte solvation and ionic association: Cyclic carbonate and Ester-LiTFSI and -LiPF6 mixtures}, volume={50}, number={26}, booktitle={Lithium-ion batteries -and- non-aqueous electrolytes for lithium batteries - prime 2012}, author={Seo, D. M. and Allen, J. L. and Gardner, L. A. and Han, S. and Boyle, P. D. and Henderson, W. A.}, year={2013}, pages={375–380} } @article{borodin_henderson_fox_berman_gobet_greenbaum_2013, title={Influence of solvent on ion aggregation and transport in PY15TFSI ionic liquid-aprotic solvent mixtures}, volume={117}, number={36}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Borodin, O. and Henderson, W. A. and Fox, E. T. and Berman, M. and Gobet, M. and Greenbaum, S.}, year={2013}, pages={10581–10588} } @article{gebbie_valtiner_banquy_fox_henderson_israelachvili_2013, title={Ionic liquids behave as dilute electrolyte solutions}, volume={110}, number={24}, journal={Proceedings of the National Academy of Sciences of the United States of America}, author={Gebbie, M. A. and Valtiner, M. and Banquy, X. and Fox, E. T. and Henderson, W. A. and Israelachvili, J. N.}, year={2013}, pages={9674–9679} } @article{allen_mcowen_delp_fox_dickmann_han_zhou_jow_henderson_2013, title={N-Alkyl-N-methylpyrrolidinium difluoro(oxalato)borate ionic liquids: Physical/electrochemical properties and Al corrosion}, volume={237}, journal={Journal of Power Sources}, author={Allen, J. L. and McOwen, D. W. and Delp, S. A. and Fox, E. T. and Dickmann, J. S. and Han, S. D. and Zhou, Z. B. and Jow, T. R. and Henderson, W. A.}, year={2013}, pages={104–111} } @article{fox_paillard_borodin_henderson_2013, title={Physicochemical properties of binary ionic liquid-aprotic solvent electrolyte mixtures}, volume={117}, number={1}, journal={Journal of Physical Chemistry. C}, author={Fox, E. T. and Paillard, E. and Borodin, O. and Henderson, W. A.}, year={2013}, pages={78–84} } @misc{gebbie_valtiner_banquy_henderson_israelachvili_2013, title={Reply to Perkin et al.: Experimental observations demonstrate that ionic liquids form both bound (Stern) and diffuse electric double layers}, volume={110}, number={44}, journal={Proceedings of the National Academy of Sciences of the United States of America}, author={Gebbie, M. A. and Valtiner, M. and Banquy, X. and Henderson, W. A. and Israelachvili, J. N.}, year={2013}, pages={E4122–4122} } @article{han_allen_jonsson_johansson_mcowen_boyle_henderson_2013, title={Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes}, volume={117}, ISSN={["1932-7447"]}, DOI={10.1021/jp309102c}, abstractNote={Lithium difluoro(oxalato)borate (LiDFOB) is a relatively new salt designed for battery electrolyte usage. Limited information is currently available, however, regarding the ionic interactions of this salt (i.e., solvate formation) when it is dissolved in aprotic solvents. Vibrational spectroscopy is a particularly useful tool for identifying these interactions, but only if the vibrational bands can be correctly linked to specific forms of anion coordination. Single crystal structures of LiDFOB solvates have therefore been used to both explore the DFOB-center dot center dot center dot Li+ cation coordination interactions and serve as unambiguous models for the assignment of the Raman vibrational bands. The solvate crystal structures determined indude (monoglyme)(2):LiDFOB, (1,2-diethoxyethane)(3/2):LiDFOB, (acetonitrile)(3):LiDFOB, (acetonitrile)(1):LiDFOB, (dimethyl carbonate)(3/2):LiDFOB, (succinonitrile)(1):LiDFOB, (adiponitrile)(1):LiDFOB, (PMDETA)(1):LiDFOB, (CRYPT-222)(2/3):LiDFOB, and (propylene carbonate)(1):LiDFOB. DFT calculations have been incorporated to provide additional insight into the origin (i.e., vibrational modes) of the Raman vibrational bands to aid in the interpretation of the experimental analysis.}, number={11}, journal={JOURNAL OF PHYSICAL CHEMISTRY C}, author={Han, Sang-Don and Allen, Joshua L. and Jonsson, Erlendur and Johansson, Patrik and McOwen, Dennis W. and Boyle, Paul D. and Henderson, Wesley A.}, year={2013}, month={Mar}, pages={5521–5531} } @inproceedings{allen_seo_mcowen_han_knight_boyle_henderson_2013, title={Thermal phase behavior and electrochemical/physicochemical properties of carbonate and ester electrolytes with LiBF4, LiDFOB and LiBOB}, volume={50}, number={26}, booktitle={Lithium-ion batteries -and- non-aqueous electrolytes for lithium batteries - prime 2012}, author={Allen, J. L. and Seo, D. M. and McOwen, D. W. and Han, S. D. and Knight, B. A. and Boyle, P. D. and Henderson, W. A.}, year={2013}, pages={381–387} } @inproceedings{seo_afroz_ly_o'connell_boyle_henderson_2012, title={A "Looking Glass" into electrolyte properties: Cyclic carbonate and ester-LiClO4 mixtures}, volume={41}, number={41}, booktitle={Rechargeable lithium and lithium ion batteries}, author={Seo, D. M. and Afroz, T. and Ly, Q. and O'Connell, M. and Boyle, P. D. and Henderson, W. A.}, year={2012}, pages={11–15} } @article{henderson_fylstra_de long_trulove_parsons_2012, title={Crystal structure of the ionic liquid EtNH3NO3-Insights into the thermal phase behavior of protic ionic liquids}, volume={14}, number={46}, journal={Physical Chemistry Chemical Physics}, author={Henderson, W. A. and Fylstra, P. and De Long, H. C. and Trulove, P. C. and Parsons, S.}, year={2012}, pages={16041–16046} } @inproceedings{han_allen_boyle_henderson_2012, title={Delving into the properties and solution structure of nitrile-lithium difluoro(oxalato)borate (LiDFOB) electrolytes for Li-ion batteries}, volume={41}, number={41}, booktitle={Rechargeable lithium and lithium ion batteries}, author={Han, S. D. and Allen, J. L. and Boyle, P. D. and Henderson, W. A.}, year={2012}, pages={47–51} } @article{herriot_khatun_fox_judeinstein_armand_henderson_greenbaum_2012, title={Diffusion coefficients from 13C PGSE NMR measurements--Fluorine-free ionic liquids with the DCTA- anion}, volume={3}, number={3}, journal={The Journal of Physical Chemistry Letters}, author={Herriot, C. and Khatun, S. and Fox, E. T. and Judeinstein, P. and Armand, M. and Henderson, W. A. and Greenbaum, S.}, year={2012}, pages={441–444} } @article{seo_borodin_han_boyle_henderson_2012, title={Electrolyte Solvation and Ionic Association II. Acetonitrile-Lithium Salt Mixtures: Highly Dissociated Salts}, volume={159}, ISSN={["1945-7111"]}, DOI={10.1149/2.035209jes}, abstractNote={The electrolyte solution structure for acetonitrile (AN)-lithium salt mixtures has been examined for highly dissociated salts. Phase diagrams are reported for (AN)n-LiN(SO2CF3)2 (LiTFSI) and -LiPF6 electrolytes. Single crystal structures and Raman spectroscopy have been utilized to provide information regarding the solvate species present in the solid-state and liquid phases, as well as the average solvation number variation with salt concentration. Molecular dynamics (MD) simulations of the mixtures have been correlated with the experimental data to provide additional insight into the molecular-level interactions. Quantum chemistry (QC) calculations were performed on (AN)n-Li-(anion)m clusters to validate the ability of the developed many-body polarizable force field (used for the simulations) to accurately describe cluster stability (ionic association). The combination of these techniques provides tremendous insight into the solution structure within these electrolyte mixtures.}, number={9}, journal={JOURNAL OF THE ELECTROCHEMICAL SOCIETY}, author={Seo, Daniel M. and Borodin, Oleg and Han, Sang-Don and Boyle, Paul D. and Henderson, Wesley A.}, year={2012}, pages={A1489–A1500} } @inbook{lex-balducci a._s._2012, title={Electrolytes for Lithium-Ion Battery Materials}, ISBN={9781439841280}, booktitle={Lithium Ion Batteries: Advanced Materials and Technologies}, publisher={Boca Raton : CRC Press}, author={Lex-Balducci A., Henderson W. A. and S., Passerini}, editor={Yuan, Y. and Liu, H. and J., Zhang.Editors}, year={2012} } @article{henderson_2012, title={Influence of polymer chain length and chains ends on polyelectrolyte solvate structure and melting point}, volume={217}, journal={Solid State Ionics}, author={Henderson, W. A.}, year={2012}, pages={1–5} } @article{seo_boyle_borodin_henderson_2012, title={Li+ cation coordination by acetonitrile-insights from crystallography}, volume={2}, ISSN={["2046-2069"]}, DOI={10.1039/c2ra21290k}, abstractNote={Solvation is a critical factor for determining the properties of electrolytes and lithium reagents, but only limited information is available about the coordination number for Li+ cations in solution with different solvents. The present manuscript examines the manner in which acetonitrile (AN) fully solvates Li+ cations. The results are also likely pertinent to other nitrile and dinitrile solvents. In particular, the crystal structure for a (AN)6:LiPF6 solvate is reported—this is the first 6/1 AN/Li solvate structure to be determined. The structure consists of Li+ cations fully solvated by four AN molecules (i.e., [(AN)4Li]+ species), uncoordinated PF6− anions and uncoordinated AN molecules (two per Li+ cation). This structure validates, in part, density functional theory (DFT) calculations which predict that there is little to no energetic benefit to coordinating Li+ cations with more than four AN solvent molecules.}, number={21}, journal={RSC ADVANCES}, author={Seo, Daniel M. and Boyle, Paul D. and Borodin, Oleg and Henderson, Wesley A.}, year={2012}, pages={8014–8019} } @article{montanino_moreno_alessandrini_appetecchi_passerini_zhou_henderson_2012, title={Physical and electrochemical properties of binary ionic liquid mixtures: (1-x) PYR14TFSI-(x) PYR14IM14}, volume={60}, journal={Electrochimica Acta}, author={Montanino, M. and Moreno, M. and Alessandrini, F. and Appetecchi, G. B. and Passerini, S. and Zhou, Q. and Henderson, W. A.}, year={2012}, pages={163–169} } @article{geng_henderson_2012, title={Pretreatment of corn stover by combining ionic liquid dissolution with alkali extraction}, volume={109}, number={1}, journal={Biotechnology and Bioengineering}, author={Geng, X. L. and Henderson, W. A.}, year={2012}, pages={84–91} } @inproceedings{allen_seo_ly_boyle_henderson_2012, title={Solvent-LiBF4 phase diagrams, ionic association and solubility - cyclic carbonates and lactones}, volume={41}, number={41}, booktitle={Rechargeable lithium and lithium ion batteries}, author={Allen, J. L. and Seo, D. M. and Ly, Q. D. and Boyle, P. D. and Henderson, W. A.}, year={2012}, pages={41–45} } @article{fox_weaver_henderson_2012, title={Tuning Binary Ionic Liquid Mixtures: Linking Alkyl Chain Length to Phase Behavior and Ionic Conductivity}, volume={116}, ISSN={["1932-7447"]}, DOI={10.1021/jp300667h}, abstractNote={The use of mixed salts to generate new composite ionic liquids (ILs) provides a facile means of readily tuning or tailoring the desired properties of ionic media. Despite this, very little information is available about how the structure of the selected ions and composition impacts the properties of salt mixtures. To explore this, six binary IL1–IL2 mixtures based on N-alkyl-N-methylpyrrolidinium bis(trifluoromethanesulfonyl)imide salts have been characterized. The physicochemical properties (density, viscosity, and ionic conductivity) and phase behavior of these mixtures are reported. The variation of the alkyl chains lengths on the cations plays a significant role in determining both the phase behavior and the physicochemical properties of the mixtures. Notably, the “tunability” of the properties of the IL mixtures is much easier to control than is found by simply making small structural changes to the ions in a given salt.}, number={8}, journal={JOURNAL OF PHYSICAL CHEMISTRY C}, author={Fox, Eric T. and Weaver, Joshua E. F. and Henderson, Wesley A.}, year={2012}, month={Mar}, pages={5271–5275} } @article{allen_han_boyle_henderson_2011, title={Crystal structure and physical properties of lithium difluoro(oxalato)borate (LiDFOB or LiBF(2)Ox)}, volume={196}, ISSN={["1873-2755"]}, DOI={10.1016/j.jpowsour.2011.07.065}, abstractNote={The structural characterization and properties of lithium difluoro(oxalato)borate (LiDFOB) are reported. LiDFOB was synthesized as previously described in the literature via direct reaction of boron trifluoride diethyl etherate with lithium oxalate. The crystal structure of the salt was determined from single crystal X-ray diffraction yielding a highly symmetric orthorhombic structure (Cmcm, a = 6.2623(8) Å, b = 11.4366(14) Å, c = 6.3002(7) Å, V = 451.22(9) Å3, Z = 4 at 110 K). Single crystal X-ray diffraction of a dihydrate of LiDFOB yielded a monoclinic structure (P21/c, a = 9.5580(3) Å, b = 12.7162(4) Å, c = 5.4387(2) Å, V = 634.63(4) Å3, Z = 4 at 110 K). Along with the crystal structures, additional structural information and the properties of LiDFOB (via 11B and 19F NMR, DSC, TGA and Raman spectroscopy) have been compared with those of LiBF4 and LiBOB to better understand the differences between these lithium battery electrolyte salts.}, number={22}, journal={JOURNAL OF POWER SOURCES}, author={Allen, Joshua L. and Han, Sang-Don and Boyle, Paul D. and Henderson, Wesley A.}, year={2011}, month={Nov}, pages={9737–9742} } @inbook{lex-balducci_henderson w._passerini_2011, title={Electrolytes for lithium ion battery materials}, ISBN={9781439841280}, booktitle={Lithium-Ion Batteries: Advanced Materials and Technologies}, publisher={Boca Raton, FL : CRC Press,}, author={Lex-Balducci, A. and Henderson W. and Passerini, S.}, editor={Yuan, Y. and Liu, H. and Zhang, J.Editors}, year={2011}, pages={147–184} } @article{zhou_boyle_malpezzi_mele_shin_passerini_henderson_2011, title={Phase Behavior of Ionic Liquid-LiX Mixtures: Pyrrolidinium Cations and TFSI- Anions - Linking Structure to Transport Properties}, volume={23}, ISSN={["0897-4756"]}, DOI={10.1021/cm201427k}, abstractNote={The thermal phase behavior and ionic conductivity of mixtures of N-alkyl-N-methylpyrrolidinium bis(trifluoromethanesulfonyl)imide ionic liquids (PY1RTFSI where R = 4 or 5 for butyl or pentyl) with LiTFSI have been examined as model systems for ionic liquid-based lithium battery electrolytes. Several mixed salt crystalline phases form. The ionic conductivity variability of the mixtures correlates well with the reported phase behavior. The crystal structures for the (1-x) PY1RTFSI-(x) LiTFSI (x = 0.67) (or 1/2 PY1RTFSI/LiTFSI with R = 4 or 5) phases have been determined. These phases are isostructural, consisting of ionic planar layers formed by Li+···TFSI– linkages in which the uncoordinated PY1R+ cations reside in cavities within the layers. These structures have been used to aid in correlating Raman data with cation–anion coordination in the IL-LiTFSI binary salt mixtures.}, number={19}, journal={CHEMISTRY OF MATERIALS}, author={Zhou, Qian and Boyle, Paul D. and Malpezzi, Luciana and Mele, Andrea and Shin, Joon-Ho and Passerini, Stefano and Henderson, Wesley A.}, year={2011}, month={Oct}, pages={4331–4337} } @article{seo_boyle_henderson_2011, title={Poly[[(acetonitrile)lithium(I)]-mu(3)-tetrafluoridoborato]}, volume={67}, ISSN={["1600-5368"]}, DOI={10.1107/s1600536811012141}, abstractNote={The structure of the title compound, [Li(BF4)(CH3CN)]n, consists of a layered arrangement parallel to (100) in which the Li+ cations are coordinated by three F atoms from three tetrafluoridoborate (BF4 −) anions and an N atom from an acetonitrile molecule. The BF4 − anion is coordinated to three different Li+ cations though three F atoms. The structure can be described as being built from vertex-shared BF4 and LiF3(NCCH3) tetrahedra. These tetrahedra reside around a crystallographic inversion center and form 8-membered rings.}, journal={ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE}, author={Seo, Daniel M. and Boyle, Paul D. and Henderson, Wesley A.}, year={2011}, month={May}, pages={M547–U443} } @article{seo_boyle_henderson_2011, title={Poly[bis(acetonitrile-kappa N)bis[mu(3)-bis(trifluoromethanesulfonyl)imido-kappa O-4,O ':O '':O ''']dilithium]}, volume={67}, journal={Acta Crystallographica. Section E, Structure Reports Online}, author={Seo, D. M. and Boyle, P. D. and Henderson, W. A.}, year={2011}, pages={M534–317} } @article{allen_boyle_henderson_2011, title={Poly[diacetonitrile[mu(3)-difluoro(oxalato)borato]sodium]}, volume={67}, journal={Acta Crystallographica. Section E, Structure Reports Online}, author={Allen, J. L. and Boyle, P. D. and Henderson, W. A.}, year={2011}, pages={M678–388} } @article{seo_boyle_henderson_2011, title={Tetrakis(acetonitrile-kappa N) lithium hexafluoridophosphate acetonitrile monosolvate}, volume={67}, journal={Acta Crystallographica. Section E, Structure Reports Online}, author={Seo, D. M. and Boyle, P. D. and Henderson, W. A.}, year={2011}, pages={M1148–1301} } @article{reichert_henderson_trulove_urban_de long_2010, title={Effects of crystal packing on the thermal behavior of N,N''-alkylpiperidinium and N,N''-alkylmorpholinium iodide salts}, volume={32}, number={7}, journal={ECS Transactions}, author={Reichert, W. M. and Henderson, W. A. and Trulove, P. C. and Urban, J. J. and De Long, H. C.}, year={2010}, pages={667–677} } @article{henderson_2010, title={Electrochemistry in Nonaqueous Solutions: Revised and Enlarged 2nd ed by Kosuke Izutsu}, volume={132}, number={30}, journal={Journal of the American Chemical Society}, author={Henderson, W. A}, year={2010}, pages={10615–10616} } @article{jow_henderson_lucht_ue_2010, title={Non-Aqueous Electrolytes for Lithium Batteries}, volume={16}, number={35}, journal={Electrochemical Society}, author={Jow, T. R. and Henderson, W. and Lucht, B. and Ue, M.}, year={2010}, pages={230} } @article{zhou_fitzgerald_boyle_henderson_2010, title={Phase Behavior and Crystalline Phases of Ionic Liquid-Lithium Salt Mixtures with 1-Alkyl-3-methylimidazolium Salts}, volume={22}, ISSN={["1520-5002"]}, DOI={10.1021/cm902691v}, abstractNote={The thermal phase behavior of 1-alkyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide (IM10RTFSI where R = 1, 2, or 4 for methyl, ethyl or butyl, respectively) ionic liquid binary mixtures with LiTFSI have been investigated as models for electrolytes for lithium batteries. Diverse phase behavior is found with significant variations noted from similar mixtures in which the imidazolium cations are replaced with N-alkyl-N-methylpyrrolidinium cations. The crystal structure for a (1−x) IM101TFSI-(x) LiTFSI (x = 0.50) (or 1/1 IM101TFSI/LiTFSI) phase is reported to further clarify the molecular level interactions occurring in these binary salt mixtures.}, number={3}, journal={CHEMISTRY OF MATERIALS}, author={Zhou, Qian and Fitzgerald, Kendall and Boyle, Paul D. and Henderson, Wesley A.}, year={2010}, month={Feb}, pages={1203–1208} } @article{zhou_henderson_appetecchi_passerini_2010, title={Phase behavior and thermal properties of ternary ionic liquid-lithium salt (IL-IL-LiX) electrolytes}, volume={114}, number={13}, journal={Journal of Physical Chemistry. C}, author={Zhou, Q. and Henderson, W. A. and Appetecchi, G. B. and Passerini, S.}, year={2010}, pages={6201–6204} } @article{paillard_zhou_henderson_appetecchi_montanino_passerini_2009, title={Electrochemical and Physicochemical Properties of PY(14)FSI-Based Electrolytes with LiFSI}, volume={156}, ISSN={["0013-4651"]}, DOI={10.1149/1.3208048}, abstractNote={We report here the characterization of Li battery electrolytes based upon the N-butyl-N-methylpyrrolidinium bis(fluorosulfonyl)imide ionic liquid (PY 14 FSI) with lithium bis(fluorosulfonyl)imide (LiFSI) as a support salt. These electrolytes show low viscosity relative to other pyrrolidinium-based ionic liquids (ILs) and corresponding higher conductivity at subambient temperatures. The melting point of the IL decreases with the addition of LiFSI and concentrated samples remain totally amorphous. The electrolytes exhibit decreased thermal stability and increased parasitic cathodic reactions with increasing LiFSI fraction relative to the pure IL, probably due to a higher impurity level for the commercial LiFSI. Despite this, the electrolytes have excellent lithium cycling behavior at 20°C.}, number={11}, journal={JOURNAL OF THE ELECTROCHEMICAL SOCIETY}, author={Paillard, Elie and Zhou, Qian and Henderson, Wesley A. and Appetecchi, Giovanni B. and Montanino, Maria and Passerini, Stefano}, year={2009}, pages={A891–A895} } @inproceedings{paillard_zhou_henderson_appetecchi_montanino_passerini_2009, title={Electrochemical and physicochemical properties of PYR14-FSI based electrolytes with LiFSI}, booktitle={ECS Transactions}, author={Paillard, E. and Zhou, Q. and Henderson, W. A. and Appetecchi, G. B. and Montanino, M. and Passerini, S.}, year={2009}, pages={51–57} } @article{brown_geng_mcdanel_henderson_2009, title={Exploring the influence of ionic liquid ion structure on cellulose solvation}, volume={16}, number={49}, journal={ECS Transactions}, author={Brown, K. and Geng, X. and McDanel, W. and Henderson, W. A.}, year={2009}, pages={107–110} } @article{jow_henderson_lucht_ue_2009, title={Non-Aqueous Electrolytes for Lithium Batteries}, volume={16}, number={35}, journal={Electrochemical Society}, author={Jow, T. R. and Henderson, W. and Lucht, B. and Ue, M}, year={2009}, pages={230} } @inbook{passerini_henderson_2009, title={Secondary batteries - lithium rechargeable systems - electrolytes: Ionic liquids}, ISBN={9780444520937}, booktitle={Encyclopedia of Electrochemical Power Sources}, publisher={Amsterdam : Elsevier}, author={Passerini, S. and Henderson, W. A.}, year={2009} } @article{henderson_passerini_de long_trulove_2008, title={Phase behavior and conductivity of Et4NTFSI-LiTFSI mixtures - a model system for ionic liquid lithium battery electrolytes}, volume={11}, number={29}, journal={ECS Transactions}, author={Henderson, W. A. and Passerini, S. and De Long, H. C. and Trulove, P. C.}, year={2008}, pages={115–118} } @article{zhou_henderson_appetecchi_montanino_passerini_2008, title={Physical and electrochemical properties of N-Alkyl-N-methylpyrrolidinium Bis(fluorosulfonyl)imide ionic liquids: PY13FSI and PY14FSI}, volume={112}, number={43}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Zhou, Q. and Henderson, W. A. and Appetecchi, G. B. and Montanino, M. and Passerini, S.}, year={2008}, pages={13577–13580} } @article{hanley_green_henderson_fox_de long_trulove_2007, title={Amino acid based ionic liquids: Solvents for improved biopolymer dissolution}, volume={3}, number={35}, journal={ECS Transactions}, author={Hanley, M. G. and Green, J. M. and Henderson, W. A. and Fox, D. M. and De Long, H. C. and Trulove, P. C.}, year={2007}, pages={41–48} } @article{henderson_2007, title={Crystallization kinetics of glyme-LiX and PEO-LiX polymer electrolytes}, volume={40}, ISSN={["1520-5835"]}, DOI={10.1021/ma061866d}, abstractNote={The crystallization kinetics of oligomeric polyethers (glymes) and poly(ethylene oxide) (PEO) with a wide range of lithium salts including LiBETI, LiTFSI, LiAsF6, LiPF6, LiClO4, LiI, LiBF4, LiCF3SO3, LiNO3, and LiCF3CO2 have been examined in detail. Wide variations exist between the rates of crystallization of the phases. These variations are strongly dependent upon the lithium salt present and are well correlated with the ionic association behavior of the different lithium salts in aprotic solvents.}, number={14}, journal={MACROMOLECULES}, author={Henderson, Wesley A.}, year={2007}, month={Jul}, pages={4963–4971} } @article{widegren_wang_henderson_magee_2007, title={Relative volatilities of ionic liquids by vacuum distillation of mixtures}, volume={111}, number={30}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Widegren, J. A. and Wang, Y.-M. and Henderson, W. A. and Magee, J. W.}, year={2007}, pages={8959–8964} } @article{grondin_talaga_lassegues_johansson_henderson_2007, title={Spectroscopic and ab initio characterization of the conformational states of the bis(perfluoroethane-sulfonyl)imide anion (BETI-)}, volume={38}, number={1}, journal={Journal of Raman Spectroscopy: JRS}, author={Grondin, J. and Talaga, D. and Lassegues, J. C. and Johansson, P. and Henderson, W. A.}, year={2007}, pages={53–60} } @article{fox_fylstra_hanley_henderson_trulove_bellayer_gilman_de long_2007, title={The preparation and characterization of bombyx mori silk nanocomposites using ionic liquids}, volume={3}, number={35}, journal={ECS Transactions}, author={Fox, D. M. and Fylstra, P. and Hanley, M. and Henderson, W. and Trulove, P. C. and Bellayer, S. and Gilman, J. W. and De Long, H. C.}, year={2007}, pages={11–20} } @article{henderson_trulove_delong_young_2007, title={What makes an ionic liquid a liquid? The impact of structure on ionic liquid properties}, volume={3}, number={35}, journal={ECS Transactions}, author={Henderson, W. A. and Trulove, P. C. and DeLong, H. C. and Young, V. G., Jr.}, year={2007}, pages={83–88} } @article{henderson_young_fylstra_de long_trulove_2006, title={Alkyl vs. alkoxy chains on ionic liquid cations}, volume={35}, journal={Chemical Communications (Cambridge, England)}, author={Henderson, W. A. and Young, V. G., Jr. and Fylstra, P. and De Long, H. C. and Trulove, P. C.}, year={2006}, pages={3708–3710} } @article{shin_henderson_tizzani_passerini_jeong_kim_2006, title={Characterization of solvent-free polymer electrolytes consisting of ternary PEO-LiTFSI-PYR14TFSI}, volume={153}, number={9}, journal={Journal of the Electrochemical Society}, author={Shin, J.-H. and Henderson, W. A. and Tizzani, C. and Passerini, S. and Jeong, S.-S. and Kim, K.-W.}, year={2006}, pages={A1649–A1654} } @article{herstedt_henderson_smirnov_ducasse_servant_talaga_lassegues_2006, title={Conformational isomerism and phase transitions in tetraethylammonium bis(trifluoromethanesulfonyl)imide Et4NTFSI}, volume={783}, number={1-3}, journal={Journal of Molecular Structure [including Theochem]}, author={Herstedt, M. and Henderson, W. A. and Smirnov, M. and Ducasse, L. and Servant, L. and Talaga, D. and Lassegues, J. C.}, year={2006}, pages={145–156} } @article{henderson_young_fylstra_de long_trulove_2006, title={Crystal packing, steric effects, and heteroatoms: Comparison of N,N-dimethylpyrrolidinium, piperidinium, and morpholinium iodide salts}, volume={6}, number={7}, journal={Crystal Growth and Design}, author={Henderson, W. A. and Young, V. G., Jr. and Fylstra, P. and De Long, H. C. and Trulove, P. C.}, year={2006}, pages={1645–1648} } @article{henderson_2006, title={Glyme-lithium salt phase behavior}, volume={110}, number={26}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Henderson, W. A.}, year={2006}, pages={13177–13183} } @article{borodin_smith_henderson_2006, title={Li+ cation environment, transport, and mechanical properties of the LiTFSI doped N-methyl-N-alkylpyrrolidinium+TFSI- ionic liquids}, volume={110}, number={34}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Borodin, O. and Smith, G. D. and Henderson, W.}, year={2006}, pages={16879–16886} } @article{henderson_herstedt_young_passerini_de long_trulove_2006, title={New disordering mode for TFSI- anions: The nonequilibrium, plastic crystalline structure of Et4NTFSI}, volume={45}, number={4}, journal={Inorganic Chemistry}, author={Henderson, W. A. and Herstedt, M. and Young, V. G., Jr. and Passerini, S. and De Long, H. C. and Trulove, P. C.}, year={2006}, pages={1412–1414} } @article{henderson_young_passerini_trulove_de long_2006, title={Plastic phase transitions in N-ethyl-N-methylpyrrolidinium bis(trifluoromethanesulfonyl)imide}, volume={18}, number={4}, journal={Chemistry of Materials}, author={Henderson, W. A. and Young, V. G., Jr. and Passerini, S. and Trulove, P. and De Long, H. C.}, year={2006}, pages={934–938} } @article{shin_henderson_scaccia_prosini_passerini_2006, title={Solid-state Li/LiFePO4 polymer electrolyte batteries incorporating an ionic liquid cycled at 40 degrees C}, volume={156}, number={2}, journal={Journal of Power Sources}, author={Shin, J.-H. and Henderson, W. A. and Scaccia, S. and Prosini, P. P. and Passerini, S.}, year={2006}, pages={560–566} } @article{henderson_young_pearson_passerini_de long_trulove_2006, title={Thermal phase behaviour of N-alkyl-N-methylpyrrolidinium and piperidinium bis(trifluoromethanesulfonyl)imide salts}, volume={18}, number={46}, journal={Journal of Physics. Condensed Matter}, author={Henderson, W. A. and Young, V. G, Jr. and Pearson, W. and Passerini, S. and De Long, H. C. and Trulove, P. C.}, year={2006}, pages={10377–10390} } @article{shin_henderson_passerini_2005, title={An elegant fix for polymer electrolytes}, volume={8}, number={2}, journal={Electrochemical and Solid State Letters}, author={Shin, J.-H. and Henderson, W. A. and Passerini, S.}, year={2005}, pages={A125–A127} } @article{andreev_seneviratne_khan_henderson_frech_bruce_2005, title={Crystal structures of poly(ethylene oxide)3:LiBF4 and (diglyme)n:LiBF4 (n = 1,2)}, volume={17}, number={4}, journal={Chemistry of Materials}, author={Andreev, Y. G. and Seneviratne, V. and Khan, M. and Henderson, W. A. and Frech, R. E. and Bruce, P. G.}, year={2005}, pages={767–772} } @article{balducci_henderson_mastragostino_passerini_simon_soavi_2005, title={Cycling stability of a hybrid activated carbon//poly(3-methylthiophene) supercapacitor with N-butyl-N-methylpyrrolidinium bis(trifluoromethanesulfonyl)imide ionic liquid as electrolyte}, volume={50}, number={11}, journal={Electrochimica Acta}, author={Balducci, A. and Henderson, W. A. and Mastragostino, M. and Passerini, S. and Simon, P. and Soavi, F.}, year={2005}, pages={2233–2237} } @article{henderson_mckenna_khan_brooks_young_frech_2005, title={Glyme-lithium bis(trifluoromethanesulfonyl)imide and glyme-lithium bis(perfluoroethanesulfonyl)-imide phase behavior and solvate structures}, volume={17}, number={9}, journal={Chemistry of Materials}, author={Henderson, W. A. and McKenna, F. and Khan, M. A. and Brooks, N. R. and Young, V. G., Jr. and Frech, R.}, year={2005}, pages={2284–2289} } @article{nicotera_oliviero_henderson_appetecchi_passerini_2005, title={NMR investigation of ionic liquid-LiX mixtures: Pyrrolidinium cations and TFSI- anions}, volume={109}, number={48}, journal={Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical}, author={Nicotera, I. and Oliviero, C. and Henderson, W. A. and Appetecchi, G. B. and Passerini, S.}, year={2005}, pages={22814–22819} } @article{shin_henderson_passerini_2005, title={PEO-based polymer electrolytes with ionic liquids and their use in lithium metal-polymer electrolyte batteries}, volume={152}, number={5}, journal={Journal of the Electrochemical Society}, author={Shin, J.-H. and Henderson, W. A. and Passerini, S.}, year={2005}, pages={A978–A983} } @article{castriota_caruso_agostino_cazzanelli_henderson_passerini_2005, title={Raman investigation of the ionic liquid N-methyl-N-propylpyrrolidinium bis(trifluoromethane-sulfonyl)imide and its mixture with LiN(SO2CF3)2}, volume={109}, number={1}, journal={Journal of Physical Chemistry. A, Molecules, Spectroscopy, Kinetics, Environment & General Theory}, author={Castriota, M. and Caruso, T. and Agostino, R. G. and Cazzanelli, E. and Henderson, W. A. and Passerini, S.}, year={2005}, pages={92–96} } @article{shin_henderson_appetecchi_alessandrini_passerini_2005, title={Recent developments in the ENEA lithium metal battery project}, volume={50}, number={19}, journal={Electrochimica Acta}, author={Shin, J.-H. and Henderson, W. A. and Appetecchi, G. B. and Alessandrini, F. and Passerini, S.}, year={2005}, pages={3859–3865} } @article{pappenfus_henderson_owens_mann_smyrl_2004, title={Complexes of lithium imide salts with tetraglyme and their polyelectrolyte composite materials}, volume={151}, number={2}, journal={Journal of the Electrochemical Society}, author={Pappenfus, T. M. and Henderson, W. A. and Owens, B. B. and Mann, K. R. and Smyrl, W. H.}, year={2004}, pages={A209–A215} } @article{pappenfus_henderson_owens_mann_smyrl_2004, title={Ionic conductivity of a poly(vinylpyridinium)/silver iodide solid polymer electrolyte system}, volume={171}, number={1-2}, journal={Solid State Ionics}, author={Pappenfus, T. M. and Henderson, W. A. and Owens, B. B. and Mann, K. R. and Smyrl, W. H.}, year={2004}, pages={41–44} } @article{henderson_brooks_brennessel_young_2004, title={LiClO4 electrolyte solvate structures}, volume={151}, number={2}, journal={Journal of Physical Chemistry. A, Molecules, Spectroscopy, Kinetics, Environment & General Theory}, author={Henderson, W. A. and Brooks, N. R. and Brennessel, W. W. and Young, V. G., Jr.}, year={2004}, pages={A209–A215} } @article{henderson_passerini_2004, title={Phase behavior of ionic liquid-LiX mixtures: Pyrrolidinium cations and TFSI- anions}, volume={16}, number={15}, journal={Chemistry of Materials}, author={Henderson, W. A. and Passerini, S.}, year={2004}, pages={2881–2885} } @article{grondin_talaga_lassegues_henderson_2004, title={Raman study of crystalline solvates between glymes CH3(OCH2CH2)nOCH3 (n = 1, 2 and 3) and LiClO4}, volume={6}, number={5}, journal={Physical Chemistry Chemical Physics}, author={Grondin, J. and Talaga, D. and Lassegues, J.-C. and Henderson, W. A.}, year={2004}, pages={938–944} } @article{grondin_lassegues_chami_servant_talaga_2004, title={Raman study of tetraglyme-LiClO4 solvate structures}, volume={6}, number={17}, journal={Physical Chemistry Chemical Physics}, author={Grondin, J. and Lassegues, J.-C. and Chami, M. and Servant, L. and Talaga, D}, year={2004}, pages={4260–4267} } @article{henderson_brooks_2003, title={Crystals from concentrated glyme mixtures. The single-crystal structure of LiClO4.}, volume={42}, number={15}, journal={Inorganic Chemistry}, author={Henderson, W. A. and Brooks, N. R.}, year={2003}, pages={4522–4524} } @article{henderson_passerini_2003, title={Ionic conductivity in crystalline-amorphous polymer electrolytes - P(EO)6:LiX phases}, volume={5}, number={7}, journal={Electrochemistry Communications}, author={Henderson, W. A. and Passerini, S.}, year={2003}, pages={575–578} } @article{shin_henderson_passerini_2003, title={Ionic liquids to the rescue? Overcoming the ionic conductivity limitations of polymer electrolytes}, volume={5}, number={12}, journal={Electrochemistry Communications}, author={Shin, J.-H. and Henderson, W. A. and Passerini, S.}, year={2003}, pages={1016–1020} } @article{pappenfus_henderson_owens_mann_smyrl_2003, title={Ionic-liquid/ polymer electrolyte composite materials for electrochemical device applications}, volume={88}, journal={Proceedings of the ACS Division of Polymeric Materials: Science & Engineering}, author={Pappenfus, T. M. and Henderson, W. A. and Owens, B. B. and Mann, K. R. and Smyrl, W. H.}, year={2003}, pages={302} } @article{capiglia_imanishi_takeda_henderson_passerini_2003, title={Poly(ethylene oxide) LiN(SO2CF2CF3)2 polymer electrolytes}, volume={150}, number={4}, journal={Journal of the Electrochemical Society}, author={Capiglia, C. and Imanishi, N. and Takeda, Y. and Henderson, W. A. and Passerini, S.}, year={2003}, pages={A525–A531} } @article{henderson_brooks_young_2003, title={Single-crystal structures of polymer electrolytes}, volume={125}, number={40}, journal={Journal of the American Chemical Society}, author={Henderson, W. A. and Brooks, N. R. and Young, V. G., Jr.}, year={2003}, pages={4522–4524} } @article{henderson_brooks_young_2003, title={Tetraglyme-Li+ cation solvate structures: Models for amorphous concentrated liquid and polymer electrolytes (II)}, volume={15}, number={24}, journal={Chemistry of Materials}, author={Henderson, W. A. and Brooks, N. R. and Young, V. G., Jr.}, year={2003}, pages={4685–4690} } @article{henderson_young_brooks_smyrl_2002, title={Li+ cation coordination in [Li2(CF3SO3)2(diglyme)] and [Li3(C2F3O2)3(diglyme)]}, volume={C58}, number={10}, journal={Acta Crystallographica}, author={Henderson, W. A. and Young, V. G., Jr. and Brooks, N. R. and Smyrl, W. H.}, year={2002}, pages={m501–m503} } @article{brooks_henderson_smyrl_2002, title={Lithium trifluoro-methanesulfonate acetonitrile adduct}, volume={E58}, number={5}, journal={Acta Crystallographica}, author={Brooks, N. R. and Henderson, W. A. and Smyrl, W. H.}, year={2002}, pages={m176–m177} } @article{henderson_brooks_smyrl_2002, title={Polymeric [Li(NO3)(monoglyme)]n}, volume={E58}, number={9}, journal={Acta Crystallographica}, author={Henderson, W. A. and Brooks, N. R. and Smyrl, W. H}, year={2002}, pages={m500–m501} } @article{appetecchi_henderson_villano_berrettoni_passerini_2001, title={PEO-LiN(SO2CF2CF3)2 polymer electrolytes I. XRD, DSC, and ionic conductivity characterization}, volume={148}, number={10}, journal={Journal of the Electrochemical Society}, author={Appetecchi, G. B. and Henderson, W. and Villano, P. and Berrettoni, M. and Passerini, S.}, year={2001}, pages={A1171–A1178} } @article{ren x._s._1997, title={Electro-osmotic drag of water in ionomeric membranes}, volume={144}, number={9}, journal={Journal of the Electrochemical Society}, author={Ren X., Henderson W. and S., Gottesfeld}, year={1997}, pages={L267–L270} }