Implicit self-consistent electrolyte model in plane-wave density-functional theory K Mathew, VS Kolluru, S Mula, SN Steinmann, RG Hennig The Journal of chemical physics 151 (23), 2019 | 767 | 2019 |
Synthesis of borophane polymorphs through hydrogenation of borophene Q Li, VSC Kolluru, MS Rahn, E Schwenker, S Li, RG Hennig, P Darancet, ... Science 371 (6534), 1143-1148, 2021 | 163 | 2021 |
Origin and regulation of oxygen redox instability in high-voltage battery cathodes X Liu, GL Xu, VSC Kolluru, C Zhao, Q Li, X Zhou, Y Liu, L Yin, Z Zhuo, ... Nature Energy 7 (9), 808-817, 2022 | 80 | 2022 |
VASPsol: Implicit solvation and electrolyte model for density-functional theory K Mathew, VSC Kolluru, RG Hennig can be found under https://github. com/henniggroup/VASPsol, 2018 | 30 | 2018 |
Discovery of chalcogenides structures and compositions using mixed fluxes X Zhou, VSC Kolluru, W Xu, L Wang, T Chang, YS Chen, L Yu, J Wen, ... Nature 612 (7938), 72-77, 2022 | 25 | 2022 |
Theory+ AI/ML for microscopy and spectroscopy: Challenges and opportunities D Unruh, VSC Kolluru, A Baskaran, Y Chen, MKY Chan MRS Bulletin 47 (10), 1024-1035, 2022 | 21 | 2022 |
Ingrained: An automated framework for fusing atomic‐scale image simulations into experiments E Schwenker, VSC Kolluru, J Guo, R Zhang, X Hu, Q Li, JT Paul, ... Small 18 (19), 2102960, 2022 | 16 | 2022 |
Role of magnetism on transition metal oxide surfaces in vacuum and solvent VSC Kolluru, RG Hennig Physical Review Materials 4 (4), 045803, 2020 | 8 | 2020 |
VASPsol: Implicit solvation and electrolyte model for density-functional theory, 2018 K Mathew, VSC Kolluru, RG Hennig | 7 | |
Efficient Sampling for Structure Search Using VAE-Organized Latent Spaces and Genetic Algorithms VSC Kolluru, N Andrejevic, M Chan Bulletin of the American Physical Society, 2024 | | 2024 |
Structure Refinement of Al-Si Interface at the Atomic Level for Identification of Two-level Systems in Superconducting Qubits S Im, VSC Kolluru, M Chan, P Voyles Bulletin of the American Physical Society, 2024 | | 2024 |
Marrying Microscopy, Modeling, and Machine Learning VSC Kolluru, E Schwenker, D Unruh, T Spreadbury, W Jiang, J Paul, ... Microscopy and Microanalysis 29 (Supplement_1), 1923-1923, 2023 | | 2023 |
Fully Automated Nanoscale to Atomistic Structure from Theory and Spectroscopy Experiments D Unruh, VS Kolluru, M Chan APS March Meeting Abstracts 2023, K28. 008, 2023 | | 2023 |
Combining generative modeling and genetic algorithm for atomistic structure search VSC Kolluru, D Unruh, J Paul, M Chan APS March Meeting Abstracts 2023, N53. 001, 2023 | | 2023 |
Structure determination from theory and experiments VSC Kolluru, E Schwenker, D Unruh, M Chan APS March Meeting Abstracts 2022, W32. 002, 2022 | | 2022 |
The Fully-Automated Nanoscale To Atomistic Structures from Theory and eXperiment (FANTASTX) code VSC Kolluru, E Schwenker, M Chan APS March Meeting Abstracts 2021, L61. 007, 2021 | | 2021 |
Grand Canonical Evolutionary Algorithm-Based Approach for Investigating Catalyst Surface Morphology P Ghanekar, VSC Kolluru, RG Hennig, J Greeley 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
Leveraging machine learning to determine nanoscale structures from theory and experiments VSC Kolluru, S Hills, E Schwenker, N Watanabe, F Sen, ... Bulletin of the American Physical Society 65, 2020 | | 2020 |