Publications

Found 58 results
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Journal Article
K.A. See, M. Leskes, J.M. Griffin, S. Britto, P.D. Matthews, A. Emly, A. Van der Ven, D.S. Wright, A.J. Morris, C.P. Grey et al. "Ab Initio Structure Search and in Situ 7Li NMR Studies of Discharge Products in the Li–S Battery System." Journal of the American Chemical Society 136 (2014): 16368-16377.
B. Swoboda, A. Van der Ven, and D. Morgan. "Assessing concentration dependence of fcc metal alloy diffusion coefficients using kinetic Monte Carlo." Journal of phase equilibria and diffusion 31 (2010): 250-259.
L. Barnard, G.A. Young, B. Swoboda, S. Choudhury, A. Van der Ven, D. Morgan, and J.D. Tucker. "Atomistic modeling of the order–disorder phase transformation in the Ni 2 Cr model alloy." Acta Materialia 81 (2014): 258-271.
Kim, Seong Shik, Daniil A. Kitchaev, Eshaan S. Patheria, Colin T. Morrell, Michelle D. Qian, Jessica L. Andrews, Qizhang Yan, Shu-Ting Ko, Jian Luo, Brent C. Melot et al. "Cation Vacancies Enable Anion Redox in Li Cathodes." Journal of the American Chemical Society 146 (2024): 20951-20962.
Saber, Muna, Colleen Reynolds, Jonathan Li, Tresa M. Pollock, and Anton Van der Ven. "Chemical and structural factors affecting the stability of Wadsley–Roth block phases." Inorganic Chemistry 62 (2023): 17317-17332.
H. Chi, H. Kim, J.C. Thomas, X. Su, S. Stackhouse, M. Kaviany, A. Van der Ven, X. Tang, and C. Uher. "Configuring pnicogen rings in skutterudites for low phonon conductivity." Physical Review B 86 (2012): 195209.
H. Chi, H. Kim, J.C. Thomas, X. Su, S. Stackhouse, M. Kaviany, A. Van der Ven, X. Tang, and C. Uher. "Configuring pnicogen rings in skutterudites for low phonon conductivity." Physical Review B 86 (2012): 195209.
Rhein, Robert K., Patrick G. Callahan, Sean P. Murray, Jean-Charles Stinville, Michael S. Titus, Anton Van der Ven, and Tresa M. Pollock. "Creep Behavior of Quinary γ′-Strengthened Co-Based Superalloys." Metallurgical and Materials Transactions A 49, no. 9 (2018).
A. Saracibar, A. Van der Ven, and M.E. Arroyo- de Dompablo. "Crystal structure, energetics, and electrochemistry of Li2FeSiO4 polymorphs from first principles calculations." Chemistry of Materials 24 (2012): 495-503.
Leben-Higgins, Z. W., J. Vinckeviciute, J. P. Wu, N. V. Faenza, Y. Z. Li, S. Sallis, N. Pereira, Y. S. Meng, G. G. Amatucci, V. Van der Ven et al. "Distinction between Intrinsic and X-ray-Induced Oxidized Oxygen States in Li-Rich 3d Layered Oxides and LiAlO2." Journal of Physical Chemistry C 123, no. 21 (2019).
D.H. Fabini, G. Laurita, J.S. Bechtel, C.C. Stoumpos, H.A. Evans, A.G. Kontos, Y.S. Raptis, R. Falaras, A. Van der Ven, M.G. Kanatzidis et al. "Dynamic Stereochemical Activity of the Sn2+ Lone Pair in Perovskite CsSnBr3." Journal of the American Chemical Society 138 (2016): 11820-11832.
D.H. Fabini, G. Laurita, J.S. Bechtel, C.C. Stoumpos, H.A. Evans, A.G. Kontos, Y.S. Raptis, R. Falaras, A. Van der Ven, M.G. Kanatzidis et al. "Dynamic Stereochemical Activity of the Sn2+ Lone Pair in Perovskite CsSnBr3." Journal of the American Chemical Society 138 (2016): 11820-11832.
A.R. Natarajan, E.L.S. Solomon, B. Puchala, E.A. Marquis, and A. Van der Ven. "On the early stages of precipitation in dilute Mg–Nd alloys." Acta Materialia 108 (2016): 367-379.
Wyckoff, Kira E., Linus Kautzsch, Jonas L. Kaufman, Brenden R. Ortiz, Anna Kallistova, Ganesh Pokharel, Jue Liu, Keith M. Taddei, Kamila M. Wiaderek, Saul H. Lapidus et al. "Electrochemical Control of Magnetism on the Breathing Kagome Network of Li x ScMo3O8." Chemistry of Materials 35 (2023): 4945-4954.
Bashian, Nicholas H., Mateusz Zuba, Ahamed Irshad, Shona M. Becwar, Julija Vinckeviciute, Warda Rahim, Kent J. Griffith, Eric T. McClure, Joseph K. Papp, Bryan D. McCloskey et al. "Electrochemical Oxidative Fluorination of an Oxide Perovskite." Chemistry of Materials 33 (2021): 5757-5768.
J.S. Bechtel, R. Seshadri, and A. Van der Ven. "Energy landscape of molecular motion in cubic methylammonium lead iodide from first-principles." The Journal of Physical Chemistry C 120 (2016): 12403-12410.
Decolvenaere, Elizabeth, Michael Gordon, Ram Seshadri, and Anton Van der Ven. "First-principles investigation of competing magnetic interactions in (Mn, Fe) Ru 2 Sn Heusler solid solutions." Physical Review B 96 (2017): 165109.
Smithson, H, CA Marianetti, D Morgan, A Van der Ven, A Predith, and G Ceder. "First-principles study of the stability and electronic structure of metal hydrides." Physical Review B 66 (2002): 144107.
Van der Ven, Anton, Kimberly A. See, and Laurent Pilon. "Hysteresis in electrochemical systems." Battery Energy 1 (2022): 20210017.
N.M. Trease, I.D. Seymour, M.D. Radin, Haodong Liu, Hao Liu, S. Hy, N. Chernova, P. Parikh, A. Devaraj, K.M. Wiaderek et al. "Identifying the Distribution of Al3+ in LiNi0.8Co0.15Al0.05O2." Chemistry of Materials 28 (2016): 8170-8180.
Meynell, Simon A., Yolita M. Eggeler, Joshua D. Bocarsly, Daniil A. Kitchaev, Bailey E. Rhodes, Tresa M. Pollock, Stephen D. Wilson, Anton Van der Ven, Ram Seshadri, Marc De Graef et al. "Inducing skyrmion flop transitions in Co 8 Zn 8 Mn 4 at room temperature." Physical Review Materials 7 (2023): 044401.
Levin, E. E., D. A. Kitchaev, Y. M. Eggeler, J. A. Mayer, P. Behera, D. S. Gianola, A. Van der Ven, T. M. Pollock, and R. Seshadri. "Influence of plastic deformation on the magnetic properties of Heusler MnAu2Al." Physical Review Materials 5 (2021).
Eggeler, Y. M., E. E. Levin, F. Wang, D. A. Kitchaev, A. Van der Ven, R. Seshadri, T. M. Pollock, and D. S. Gianola. "Interfacial structure and strain accommodation in two-phase NbCo1.2Sn Heusler intermetallics." Physical Review Materials 4 (2020).
K. Persson, V.A. Sethuraman, L.J. Hardwick, Y. Hinuma, Y.S. Meng, A. Van der Ven, V. Srinivasan, R. Kostecki, and G. Ceder. "Lithium diffusion in graphitic carbon." The journal of physical chemistry letters 1 (2010): 1176-1180.
K. Persson, V.A. Sethuraman, L.J. Hardwick, Y. Hinuma, Y.S. Meng, A. Van der Ven, V. Srinivasan, R. Kostecki, and G. Ceder. "Lithium diffusion in graphitic carbon." The journal of physical chemistry letters 1 (2010): 1176-1180.

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