| Machine learning force fields: Construction, validation, and outlook V Botu, R Batra, J Chapman, R Ramprasad The Journal of Physical Chemistry C 121 (1), 511-522, 2017 | 489 | 2017 |
| Adaptive machine learning framework to accelerate ab initio molecular dynamics V Botu, R Ramprasad International Journal of Quantum Chemistry 115 (16), 1074-1083, 2015 | 432 | 2015 |
| Learning scheme to predict atomic forces and accelerate materials simulations V Botu, R Ramprasad Physical Review B 92 (9), 094306, 2015 | 225 | 2015 |
| Monolithically integrated spinel MxCo3− xO4 (M= Co, Ni, Zn) nanoarray catalysts: scalable synthesis and cation manipulation for tunable low‐temperature CH4 and CO oxidation Z Ren, V Botu, S Wang, Y Meng, W Song, Y Guo, R Ramprasad, SL Suib, ... Angewandte Chemie 126 (28), 7351-7355, 2014 | 214 | 2014 |
| Scoping the polymer genome: A roadmap for rational polymer dielectrics design and beyond A Mannodi-Kanakkithodi, A Chandrasekaran, C Kim, TD Huan, G Pilania, ... Materials Today 21 (7), 785-796, 2018 | 171 | 2018 |
| Tunable mesoporous manganese oxide for high performance oxygen reduction and evolution reactions IM Mosa, S Biswas, AM El-Sawy, V Botu, C Guild, W Song, R Ramprasad, ... Journal of Materials Chemistry A 4 (2), 620-631, 2016 | 123 | 2016 |
| Design Principles for Metal Oxide Redox Materials for Solar‐Driven Isothermal Fuel Production R Michalsky, V Botu, CM Hargus, AA Peterson, A Steinfeld Advanced energy materials 5 (7), 1401082, 2015 | 57 | 2015 |
| A study of adatom ripening on an Al (111) surface with machine learning force fields V Botu, J Chapman, R Ramprasad Computational Materials Science 129, 332-335, 2017 | 37 | 2017 |
| Computational approaches for investigating interfacial adhesion phenomena of polyimide on silica glass K Min, AR Rammohan, HS Lee, J Shin, SH Lee, S Goyal, H Park, ... Scientific reports 7 (1), 1-11, 2017 | 33 | 2017 |
| Ceria in an oxygen environment: Surface phase equilibria and its descriptors V Botu, R Ramprasad, AB Mhadeshwar Surface Science 619, 49-58, 2014 | 31 | 2014 |
| Effect of Nanoscale Roughness on Adhesion between Glassy Silica and Polyimides: A Molecular Dynamics Study SH Lee, RJ Stewart, H Park, S Goyal, V Botu, H Kim, K Min, E Cho, ... The Journal of Physical Chemistry C 121 (44), 24648-24656, 2017 | 19 | 2017 |
| Optimal dopant selection for water splitting with cerium oxides: mining and screening first principles data V Botu, AB Mhadeshwar, SL Suib, R Ramprasad Information Science for Materials Discovery and Design, 157-171, 2016 | 10 | 2016 |
| Enhancement of Adhesion Strength of Perfluoroalkylpolyethers on Rough Glassy Silica for Antismudge Coatings SH Lee, YN Ahn, V Botu, RJ Stewart, SY Oh ACS Applied Polymer Materials 1 (10), 2613-2621, 2019 | 6 | 2019 |
| Fundamentals of Organic-Glass Adhesion S Goyal, H Park, SH Lee, M McKenzie, A Rammohan, H Kim, JC Mauro, ... Handbook of Materials Modeling: Applications: Current and Emerging Materials …, 2020 | 4 | 2020 |
| A high-throughput ab-initio study of diverse glasses: Accuracy of the atomic structure and refractive index SH Lee, V Botu Computational Materials Science 214, 111765, 2022 | 2 | 2022 |
| Atomic properties of sodium silicate glasses obtained from the building-block method KN Subedi, V Botu, DA Drabold Physical Review B 103 (13), 134202, 2021 | 2 | 2021 |
| Surface Chemistry with Machine Learning and Quantum Mechanics V Botu | | 2016 |
