Origin of morphotropic phase boundaries in ferroelectrics M Ahart, M Somayazulu, RE Cohen, P Ganesh, P Dera, H Mao, ... Nature 451 (7178), 545-548, 2008 | 968 | 2008 |
Metal thio‐and selenophosphates as multifunctional van der Waals layered materials MA Susner, M Chyasnavichyus, MA McGuire, P Ganesh, P Maksymovych Advanced Materials 29 (38), 1602852, 2017 | 324 | 2017 |
Development of a ReaxFF potential for carbon condensed phases and its application to the thermal fragmentation of a large fullerene SG Srinivasan, ACT Van Duin, P Ganesh The Journal of Physical Chemistry A 119 (4), 571-580, 2015 | 314 | 2015 |
Ultrathin nanosheets of CrSiTe 3: a semiconducting two-dimensional ferromagnetic material MW Lin, HL Zhuang, J Yan, TZ Ward, AA Puretzky, CM Rouleau, Z Gai, ... Journal of Materials Chemistry C 4 (2), 315-322, 2016 | 289 | 2016 |
Computational discovery of ferromagnetic semiconducting single-layer HL Zhuang, Y Xie, PRC Kent, P Ganesh Physical Review B 92 (3), 035407, 2015 | 260 | 2015 |
Intrinsic thermodynamic and kinetic properties of Sb electrodes for Li-ion and Na-ion batteries: experiment and theory L Baggetto, P Ganesh, CN Sun, RA Meisner, TA Zawodzinski, GM Veith Journal of Materials Chemistry A 1 (27), 7985-7994, 2013 | 260 | 2013 |
Aqueous proton transfer across single-layer graphene JL Achtyl, RR Unocic, L Xu, Y Cai, M Raju, W Zhang, RL Sacci, ... Nature communications 6 (1), 6539, 2015 | 259 | 2015 |
Characterization of sodium ion electrochemical reaction with tin anodes: Experiment and theory L Baggetto, P Ganesh, RP Meisner, RR Unocic, JC Jumas, CA Bridges, ... Journal of power sources 234, 48-59, 2013 | 228 | 2013 |
Competitive lithium solvation of linear and cyclic carbonates from quantum chemistry O Borodin, M Olguin, P Ganesh, PRC Kent, JL Allen, WA Henderson Physical Chemistry Chemical Physics 18 (1), 164-175, 2016 | 208 | 2016 |
Tunable quadruple-well ferroelectric van der Waals crystals JA Brehm, SM Neumayer, L Tao, A O’Hara, M Chyasnavichus, MA Susner, ... Nature Materials 19 (1), 43-48, 2020 | 170 | 2020 |
Signature of nearly icosahedral structures in liquid and supercooled liquid copper P Ganesh, M Widom Physical Review B—Condensed Matter and Materials Physics 74 (13), 134205, 2006 | 166 | 2006 |
Understanding the origin of high-rate intercalation pseudocapacitance in Nb 2 O 5 crystals AA Lubimtsev, PRC Kent, BG Sumpter, P Ganesh Journal of Materials Chemistry A 1 (47), 14951-14956, 2013 | 160 | 2013 |
Ab initio simulations of geometrical frustration in supercooled liquid Fe and Fe-based metallic glass P Ganesh, M Widom Physical Review B—Condensed Matter and Materials Physics 77 (1), 014205, 2008 | 151 | 2008 |
Accurate static and dynamic properties of liquid electrolytes for Li-ion batteries from ab initio molecular dynamics P Ganesh, D Jiang, PRC Kent The Journal of Physical Chemistry B 115 (12), 3085-3090, 2011 | 150 | 2011 |
Role of random electric fields in relaxors D Phelan, C Stock, JA Rodriguez-Rivera, S Chi, J Leao, X Long, Y Xie, ... Proceedings of the National Academy of Sciences 111 (5), 1754-1759, 2014 | 149 | 2014 |
Liquid-liquid transition in supercooled silicon determined by first-principles simulation P Ganesh, M Widom Physical review letters 102 (7), 075701, 2009 | 149 | 2009 |
Binding and diffusion of lithium in graphite: quantum monte carlo benchmarks and validation of van der Waals density functional methods P Ganesh, J Kim, C Park, M Yoon, FA Reboredo, PRC Kent Journal of Chemical Theory and Computation 10 (12), 5318-5323, 2014 | 146 | 2014 |
Solid–electrolyte interphase formation and electrolyte reduction at Li-ion battery graphite anodes: Insights from first-principles molecular dynamics P Ganesh, PRC Kent, D Jiang The Journal of Physical Chemistry C 116 (46), 24476-24481, 2012 | 146 | 2012 |
Understanding controls on interfacial wetting at epitaxial graphene: Experiment and theory H Zhou, P Ganesh, V Presser, MCF Wander, P Fenter, PRC Kent, D Jiang, ... Physical Review B—Condensed Matter and Materials Physics 85 (3), 035406, 2012 | 145 | 2012 |
Machine learned features from density of states for accurate adsorption energy prediction V Fung, G Hu, P Ganesh, BG Sumpter Nature communications 12 (1), 88, 2021 | 142 | 2021 |