TeraChem: A graphical processing unit‐accelerated electronic structure package for large‐scale ab initio molecular dynamics S Seritan, C Bannwarth, BS Fales, EG Hohenstein, CM Isborn, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 11 (2), e1494, 2021 | 219 | 2021 |
TeraChem: Accelerating electronic structure and ab initio molecular dynamics with graphical processing units S Seritan, C Bannwarth, BS Fales, EG Hohenstein, ... The Journal of chemical physics 152 (22), 2020 | 108 | 2020 |
Scalable randomized benchmarking of quantum computers using mirror circuits T Proctor, S Seritan, K Rudinger, E Nielsen, R Blume-Kohout, K Young Physical Review Letters 129 (15), 150502, 2022 | 60 | 2022 |
Rate-enhancing roles of water molecules in methyltrioxorhenium-catalyzed olefin epoxidation by hydrogen peroxide BR Goldsmith, T Hwang, S Seritan, B Peters, SL Scott Journal of the American Chemical Society 137 (30), 9604-9616, 2015 | 43 | 2015 |
Experimental characterization of crosstalk errors with simultaneous gate set tomography K Rudinger, CW Hogle, RK Naik, A Hashim, D Lobser, DI Santiago, ... PRX Quantum 2 (4), 040338, 2021 | 40 | 2021 |
Substituent effects in mechanochemical allowed and forbidden cyclobutene ring-opening reactions CL Brown, BH Bowser, J Meisner, TB Kouznetsova, S Seritan, TJ Martinez, ... Journal of the American Chemical Society 143 (10), 3846-3855, 2021 | 33 | 2021 |
Large-scale electron correlation calculations: Rank-reduced full configuration interaction BS Fales, S Seritan, NF Settje, BG Levine, H Koch, TJ Martínez Journal of Chemical Theory and Computation 14 (8), 4139-4150, 2018 | 27 | 2018 |
Psychiatric disorders associated with FXTAS A L Seritan, M Ortigas, S Seritan, J A Bourgeois, R J Hagerman Current psychiatry reviews 9 (1), 59-64, 2013 | 27 | 2013 |
InteraChem: virtual reality visualizer for reactive interactive molecular dynamics S Seritan, Y Wang, JE Ford, A Valentini, T Gold, TJ Martínez Journal of Chemical Education 98 (11), 3486-3492, 2021 | 26 | 2021 |
TeraChem Cloud: A high-performance computing service for scalable distributed GPU-accelerated electronic structure calculations S Seritan, K Thompson, TJ Martínez Journal of Chemical Information and Modeling 60 (4), 2126-2137, 2020 | 26 | 2020 |
Performance of coupled-cluster singles and doubles on modern stream processing architectures BS Fales, ER Curtis, KG Johnson, D Lahana, S Seritan, Y Wang, H Weir, ... Journal of Chemical Theory and Computation 16 (7), 4021-4028, 2020 | 24 | 2020 |
Nitromethane Decomposition via Automated Reaction Discovery and an Ab Initio Corrected Kinetic Model J Ford, S Seritan, X Zhu, MN Sakano, MM Islam, A Strachan, TJ Martínez The Journal of Physical Chemistry A 125 (7), 1447-1460, 2021 | 23 | 2021 |
A design equation for low dosage additives that accelerate nucleation GG Poon, S Seritan, B Peters Faraday Discussions 179, 329-341, 2015 | 17 | 2015 |
Demonstrating scalable randomized benchmarking of universal gate sets J Hines, M Lu, RK Naik, A Hashim, JL Ville, B Mitchell, JM Kriekebaum, ... Physical Review X 13 (4), 041030, 2023 | 16 | 2023 |
PySpawn: Software for nonadiabatic quantum molecular dynamics DA Fedorov, S Seritan, BS Fales, TJ Martínez, BG Levine Journal of Chemical Theory and Computation 16 (9), 5485-5498, 2020 | 16 | 2020 |
Voice-controlled quantum chemistry U Raucci, A Valentini, E Pieri, H Weir, S Seritan, TJ Martínez Nature Computational Science 1 (1), 42-45, 2021 | 14 | 2021 |
Quantifying -gate-count improvements for ground-state-energy estimation with near-optimal state preparation S Pathak, AE Russo, SK Seritan, AD Baczewski Physical Review A 107 (4), L040601, 2023 | 11 | 2023 |
Stability of high-fidelity two-qubit operations in silicon T Tanttu, WH Lim, JY Huang, N Dumoulin Stuyck, W Gilbert, RY Su, ... arXiv e-prints, arXiv: 2303.04090, 2023 | 9 | 2023 |
Establishing trust in quantum computations T Proctor, S Seritan, E Nielsen, K Rudinger, K Young, R Blume-Kohout, ... arXiv preprint arXiv:2204.07568, 2022 | 6 | 2022 |
Benchmarking verified logic operations for fault tolerance A Hashim, S Seritan, T Proctor, K Rudinger, N Goss, RK Naik, ... arXiv preprint arXiv:2207.08786, 2022 | 6 | 2022 |