| Psi4: an open‐source ab initio electronic structure program JM Turney, AC Simmonett, RM Parrish, EG Hohenstein, FA Evangelista, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 2 (4), 556-565, 2012 | 770 | 2012 |
| Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability RM Parrish, LA Burns, DGA Smith, AC Simmonett, AE DePrince III, ... Journal of chemical theory and computation 13 (7), 3185-3197, 2017 | 667 | 2017 |
| Levels of symmetry adapted perturbation theory (SAPT). I. Efficiency and performance for interaction energies TM Parker, LA Burns, RM Parrish, AG Ryno, CD Sherrill The Journal of chemical physics 140 (9), 094106, 2014 | 340 | 2014 |
| Tensor hypercontraction density fitting. I. Quartic scaling second-and third-order Mřller-Plesset perturbation theory EG Hohenstein, RM Parrish, TJ Martínez The Journal of chemical physics 137 (4), 044103, 2012 | 186 | 2012 |
| Large-scale symmetry-adapted perturbation theory computations via density fitting and Laplace transformation techniques: Investigating the fundamental forces of DNA … EG Hohenstein, RM Parrish, CD Sherrill, JM Turney, HF Schaefer III The Journal of chemical physics 135 (17), 174107, 2011 | 136 | 2011 |
| Tensor hypercontraction. II. Least-squares renormalization RM Parrish, EG Hohenstein, TJ Martínez, CD Sherrill The Journal of chemical physics 137 (22), 224106, 2012 | 127 | 2012 |
| Communication: Tensor hypercontraction. III. Least-squares tensor hypercontraction for the determination of correlated wavefunctions EG Hohenstein, RM Parrish, CD Sherrill, TJ Martínez The Journal of chemical physics 137 (22), 221101, 2012 | 117 | 2012 |
| On the relationship between bond-length alternation and many-electron self-interaction error T Körzdörfer, RM Parrish, JS Sears, CD Sherrill, JL Brédas The Journal of chemical physics 137 (12), 124305, 2012 | 88 | 2012 |
| Quantum-Mechanical Evaluation of π–π versus Substituent− π Interactions in π Stacking: Direct Evidence for the Wheeler–Houk Picture RM Parrish, CD Sherrill Journal of the American Chemical Society 136 (50), 17386-17389, 2014 | 83 | 2014 |
| Do Deuteriums Form Stronger CH− π Interactions? C Zhao, RM Parrish, MD Smith, PJ Pellechia, CD Sherrill, KD Shimizu Journal of the American Chemical Society 134 (35), 14306-14309, 2012 | 75 | 2012 |
| Chemical Assignment of Symmetry-Adapted Perturbation Theory Interaction Energy Components: The Functional-Group SAPT Partition RM Parrish, TM Parker, CD Sherrill Journal of Chemical Theory and Computation 10 (10), 4417-4431, 2014 | 71 | 2014 |
| The photochemical ring-opening of 1, 3-cyclohexadiene imaged by ultrafast electron diffraction TJA Wolf, DM Sanchez, J Yang, RM Parrish, JPF Nunes, M Centurion, ... Nature chemistry 11 (6), 504, 2019 | 70 | 2019 |
| Imaging the Photochemical Ring-Opening of 1, 3-Cyclohexadiene by Ultrafast Electron Diffraction TJA Wolf, DM Sanchez, J Yang, RM Parrish, JPF Nunes, M Centurion, ... arXiv preprint arXiv:1810.02900, 2018 | 70* | 2018 |
| Imaging the Photochemical Ring-Opening of 1, 3-Cyclohexadiene by Ultrafast Electron Diffraction TJA Wolf, DM Sanchez, J Yang, RM Parrish, JPF Nunes, M Centurion, ... arXiv preprint arXiv:1810.02900, 2018 | 70* | 2018 |
| Quantum-Mechanical Analysis of the Energetic Contributions to π Stacking in Nucleic Acids versus Rise, Twist, and Slide TM Parker, EG Hohenstein, RM Parrish, NV Hud, CD Sherrill Journal of the American Chemical Society 135 (4), 1306-1316, 2013 | 70 | 2013 |
| Quartic scaling second-order approximate coupled cluster singles and doubles via tensor hypercontraction: THC-CC2 EG Hohenstein, SIL Kokkila, RM Parrish, TJ Martínez The Journal of chemical physics 138 (12), 124111, 2013 | 65 | 2013 |
| Tensor Hypercontraction Equation-of-Motion Second-Order Approximate Coupled Cluster: Electronic Excitation Energies in O (N 4) Time EG Hohenstein, SIL Kokkila, RM Parrish, TJ Martínez The Journal of Physical Chemistry B 117 (42), 12972-12978, 2013 | 64 | 2013 |
| Assessment of the performance of tuned range-separated hybrid density functionals in predicting accurate quasiparticle spectra T Körzdörfer, RM Parrish, N Marom, JS Sears, CD Sherrill, JL Brédas Physical Review B 86 (20), 205110, 2012 | 60 | 2012 |
| Spatial assignment of symmetry adapted perturbation theory interaction energy components: The atomic SAPT partition RM Parrish, CD Sherrill The Journal of Chemical Physics 141 (4), 044115, 2014 | 59 | 2014 |
| An ab initio exciton model including charge-transfer excited states X Li, RM Parrish, F Liu, SIL Kokkila Schumacher, TJ Martinez Journal of chemical theory and computation 13 (8), 3493-3504, 2017 | 56 | 2017 |
David SherrillProfessor of Chemistry, Professor of Comput. Sci. and Engineering, Georgia Institute of TechnologyVerified email at gatech.edu
