Edward G. Hohenstein, Ph.D.
Affiliations: | 2011 | Georgia Institute of Technology, Atlanta, GA |
Area:
quantum chemistryGoogle:
"Edward Hohenstein"Mean distance: 9.52
Parents
Sign in to add mentor| C. David Sherrill | grad student | 2011 | Georgia Tech | |
| (Implementation and applications of density-fitted symmetry-adapted perturbation theory.) | ||||
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Publications
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| Hohenstein EG, Fales BS, Parrish RM, et al. (2022) Rank-reduced coupled-cluster. III. Tensor hypercontraction of the doubles amplitudes. The Journal of Chemical Physics. 156: 054102 |
| Hohenstein EG, Martínez TJ. (2021) GPU acceleration of rank-reduced coupled-cluster singles and doubles. The Journal of Chemical Physics. 155: 184110 |
| Yu JK, Bannwarth C, Hohenstein EG, et al. (2020) Ab Initio Nonadiabatic Molecular Dynamics with Hole-Hole Tamm-Dancoff Approximated Density Functional Theory. Journal of Chemical Theory and Computation |
| Bannwarth C, Yu JK, Hohenstein EG, et al. (2020) Hole-hole Tamm-Dancoff-approximated density functional theory: A highly efficient electronic structure method incorporating dynamic and static correlation. The Journal of Chemical Physics. 153: 024110 |
| Fales BS, Curtis ER, Johnson KG, et al. (2020) Performance of Coupled-Cluster Singles and Doubles on Modern Stream Processing Architectures. Journal of Chemical Theory and Computation |
| Seritan S, Bannwarth C, Fales BS, et al. (2020) TeraChem: Accelerating electronic structure and ab initio molecular dynamics with graphical processing units. The Journal of Chemical Physics. 152: 224110 |
| Smith DGA, Burns LA, Simmonett AC, et al. (2020) Psi4 1.4: Open-source software for high-throughput quantum chemistry. The Journal of Chemical Physics. 152: 184108 |
| Hohenstein EG, Zhao Y, Parrish RM, et al. (2019) Rank reduced coupled cluster theory. II. Equation-of-motion coupled-cluster singles and doubles. The Journal of Chemical Physics. 151: 164121 |
| Parrish RM, Hohenstein EG, McMahon PL, et al. (2019) Quantum Computation of Electronic Transitions Using a Variational Quantum Eigensolver. Physical Review Letters. 122: 230401 |
| Parrish RM, Zhao Y, Hohenstein EG, et al. (2019) Rank reduced coupled cluster theory. I. Ground state energies and wavefunctions. The Journal of Chemical Physics. 150: 164118 |