New optimization scheme to obtain interaction potentials for oxide glasses S Sundararaman, L Huang, S Ispas, W Kob The Journal of Chemical Physics 148 (19), 2018 | 70 | 2018 |
New interaction potentials for alkali and alkaline-earth aluminosilicate glasses S Sundararaman, L Huang, S Ispas, W Kob The Journal of chemical physics 150 (15), 2019 | 47 | 2019 |
Improved Li+ Transport in Polyacetal Electrolytes: Conductivity and Current Fraction in a Series of Polymers RL Snyder, Y Choo, KW Gao, DM Halat, BA Abel, S Sundararaman, ... ACS Energy Letters 6 (5), 1886-1891, 2021 | 38 | 2021 |
New interaction potentials for borate glasses with mixed network formers S Sundararaman, L Huang, S Ispas, W Kob The Journal of chemical physics 152 (10), 2020 | 32 | 2020 |
Mechanical properties of silica glass predicted by a pair-wise potential in molecular dynamics simulations S Sundararaman, WY Ching, L Huang Journal of Non-Crystalline Solids 445, 102-109, 2016 | 32 | 2016 |
Modifying Li+ and Anion Diffusivities in Polyacetal Electrolytes: A Pulsed-Field-Gradient NMR Study of Ion Self-Diffusion DM Halat, RL Snyder, S Sundararaman, Y Choo, KW Gao, ZJ Hoffman, ... Chemistry of Materials 33 (13), 4915-4926, 2021 | 25 | 2021 |
Tailoring structure and properties of silica glass aided by computer simulation L Huang, F Yuan, M Guerette, Q Zhao, S Sundararaman Journal of Materials Research 32 (1), 174-182, 2017 | 18 | 2017 |
Understanding the response of aluminosilicate and aluminoborate glasses to sharp contact loading using molecular dynamics simulation H Liu, B Deng, S Sundararaman, Y Shi, L Huang Journal of Applied Physics 128 (3), 2020 | 16 | 2020 |
New interaction potentials for alkaline earth silicate and borate glasses YT Shih, S Sundararaman, S Ispas, L Huang Journal of Non-Crystalline Solids 565, 120853, 2021 | 12 | 2021 |
Structural origin of the anomalous density maximum in silica and alkali silicate glasses YT Shih, S Sundararaman, L Huang Journal of the American Ceramic Society 103 (7), 3942-3953, 2020 | 11 | 2020 |
Understanding the structural origin of intermediate glasses SP Jaccani, S Sundararaman, L Huang Journal of the American Ceramic Society 102 (3), 1137-1149, 2019 | 10 | 2019 |
Tensile ductility and necking in consolidated amorphous alumina Y Zhang, H Liu, S Sundararaman, L Huang, Y Shi Journal of the American Ceramic Society 105 (2), 958-965, 2022 | 6 | 2022 |
Exploring the Ion Solvation Environments in Solid-State Polymer Electrolytes through Free-Energy Sampling S Sundararaman, DM Halat, Y Choo, RL Snyder, BA Abel, GW Coates, ... Macromolecules 54 (18), 8590-8600, 2021 | 5 | 2021 |
Understanding the Impact of Multi-Chain Ion Coordination in Poly (ether-Acetal) Electrolytes S Sundararaman, DM Halat, JA Reimer, NP Balsara, D Prendergast Macromolecules 55 (21), 9880-9889, 2022 | 4 | 2022 |
Unsupervised learning of representative local atomic arrangements in molecular dynamics data F Roncoroni, A Sanz-Matias, S Sundararaman, D Prendergast Physical Chemistry Chemical Physics 25 (19), 13741-13754, 2023 | 3 | 2023 |
Ca-dimers and solvent layering determine electrochemically active species in Ca(BH) in THF A Sanz-Matìas, F Roncoroni, S Sundararaman, D Prendergast arXiv preprint arXiv:2303.08261, 2023 | 2 | 2023 |
(Invited) Analysis of Interfacial Species at Finite Bias - Calcium Borohydride in Tetrahydrofuran D Prendergast, AS Matias, F Roncoroni, S Sundararaman 245th ECS Meeting (May 26-30, 2024), 2024 | | 2024 |
Ca-dimers and solvent layering determine electrochemically active species in Ca(BH4)2 in THF D Prendergast, A Sanz Matias, F Roncoroni, S Sundararaman Bulletin of the American Physical Society, 2024 | | 2024 |
Ca-dimers, solvent layering, and dominant electrochemically active species in Ca(BH4)2 in THF A Sanz Matias, F Roncoroni, S Sundararaman, D Prendergast Nature Communications 15 (1), 1397, 2024 | | 2024 |
Ca-dimers and solvent layering determine electrochemically active species in Ca (BH4) 2 in THF AS Matias, F Roncoroni, S Sundararaman, D Prendergast | | 2023 |