Machine-learning coupled cluster properties through a density tensor representation BG Peyton, C Briggs, R D’Cunha, JT Margraf, TD Crawford The Journal of Physical Chemistry A 124 (23), 4861-4871, 2020 | 27 | 2020 |
Accelerating real-time coupled cluster methods with single-precision arithmetic and adaptive numerical integration Z Wang, BG Peyton, TD Crawford Journal of Chemical Theory and Computation 18 (9), 5479-5491, 2022 | 21 | 2022 |
Basis set superposition errors in the many-body expansion of molecular properties BG Peyton, TD Crawford The Journal of Physical Chemistry A 123 (20), 4500-4511, 2019 | 16 | 2019 |
Cavity-modified molecular dipole switching dynamics JD Weidman, MS Dadgar, ZJ Stewart, BG Peyton, IS Ulusoy, AK Wilson The Journal of Chemical Physics 160 (9), 2024 | 8 | 2024 |
Light-induced electron dynamics of molecules in cavities: comparison of model Hamiltonians BG Peyton, JD Weidman, AK Wilson JOSA B 41 (8), C74-C81, 2024 | 5 | 2024 |
PSI4EDUCATION: Free and Open-Source Programing Activities for Chemical Education with Free and Open-Source Software DB Magers, VH Chávez, BG Peyton, DA Sirianni, RC Fortenberry, ... Teaching Programming across the Chemistry Curriculum, 107-122, 2021 | 4 | 2021 |
Tailoring light-induced charge transfer and intersystem crossing in FeCO using time-dependent spin–orbit configuration interaction BG Peyton, ZJ Stewart, JD Weidman, AK Wilson The Journal of Chemical Physics 159 (20), 2023 | 3 | 2023 |
Reduced Scaling Real-Time Coupled Cluster Theory BG Peyton, Z Wang, TD Crawford The Journal of Physical Chemistry A 127 (40), 8486-8499, 2023 | 2 | 2023 |
The Efficient Computation of Field-Dependent Molecular Properties in the Frequency and Time Domains BG Peyton Virginia Tech, 2022 | | 2022 |