| Recent developments in the general atomic and molecular electronic structure system GMJ Barca, C Bertoni, L Carrington, D Datta, N De Silva, JE Deustua, ... The Journal of chemical physics 152 (15), 2020 | 890 | 2020 |
| Novel computer architectures and quantum chemistry MS Gordon, G Barca, SS Leang, D Poole, AP Rendell, JL Galvez Vallejo, ... The Journal of Physical Chemistry A 124 (23), 4557-4582, 2020 | 39 | 2020 |
| Comparisons of core and uncore frequency scaling modes in quantum chemistry application GAMESS V Sundriyal, M Sosonkina, BM Westheimer, M Gordon Proceedings of the High Performance Computing Symposium, 1-11, 2018 | 21 | 2018 |
| Core and uncore joint frequency scaling strategy V Sundriyal, M Sosonkina, B Westheimer, M Gordon Journal of Computer and Communications 6 (12), 184-201, 2018 | 17 | 2018 |
| M. W loch, P. Xu, F. Zahariev, and MS Gordon GMJ Barca, C Bertoni, L Carrington, D Datta, N De Silva, JE Deustua, ... J. Chem. Phys 152, 154102, 2020 | 11 | 2020 |
| The General Atomic and Molecular Electronic Structure System (GAMESS): Novel Methods on Novel Architectures F Zahariev, P Xu, BM Westheimer, S Webb, J Galvez Vallejo, A Tiwari, ... Journal of Chemical Theory and Computation 19 (20), 7031-7055, 2023 | 10 | 2023 |
| Maximizing performance under a power constraint on modern multicore systems V Sundriyal, M Sosonkina, B Westheimer, MS Gordon Journal of Computer and Communications 7 (7), 252-266, 2019 | 7 | 2019 |
| Toward an extreme-scale electronic structure system JL Galvez Vallejo, C Snowdon, R Stocks, F Kazemian, FC Yan Yu, ... The Journal of Chemical Physics 159 (4), 2023 | 6 | 2023 |
| Uncore frequency scaling vs dynamic voltage and frequency scaling: A quantitative comparison V Sundriyal, M Sosonkina, BM Westheimer, M Gordon Society for Modeling & Simulation International, SpringSim-HPC, 2018 | 4 | 2018 |
| General, Rigorous Approach for the Treatment of Interfragment Covalent Bonds BM Westheimer, MS Gordon The Journal of Physical Chemistry A 126 (39), 6995-7006, 2022 | 3 | 2022 |
| The Effective Fragment Potential: An Ab Initio Force Field P Xu, BM Westheimer, M Schlinsog, T Sattasathuchana, G Elliott, ... Elsevier, 2023 | 1 | 2023 |
| Developments in fragment-based quantum chemistry: Flattening the curve BM Westheimer | | 2022 |
| Scalable ab initio fragmentation methods based on a truncated expansion of the non-orthogonal molecular orbital model BM Westheimer, MS Gordon The Journal of Chemical Physics 155 (15), 2021 | | 2021 |
| Comparing frequency scaling efficacy on different memory technologies V Sundriyal, M Sosonkina, BM Westheimer 2019 Spring Simulation Conference (SpringSim), 1-10, 2019 | | 2019 |
| Multiple-time-step molecular dynamics in fragment-based calculations B Westheimer, M Gordon ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255, 2018 | | 2018 |
| Core and Uncore Joint Frequency Scaling Strategy M Gordon, M Sosonkina, B Westheimer Scientific Research Publishing Inc., 2018 | | 2018 |
