Quasi-Particle Self-Consistent GW for Molecules
Article
Kaplan, F., Harding, M. E.
, Seiler, C., Weigend, F. , Evers, F. and van Setten, M. J.
(2016)
Quasi-Particle Self-Consistent GW for Molecules.
Journal of Chemical Theory and Computation 12 (6), pp. 2528-2541.
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| Item type | Article | ||||
| Journal or Publication Title | Journal of Chemical Theory and Computation | ||||
| Publisher | AMER CHEMICAL SOC | ||||
| Place of Publication | WASHINGTON | ||||
| Volume | 12 | ||||
| Number of Issue or Book Chapter | 6 | ||||
| Page Range | pp. 2528-2541 | ||||
| Date | 2016 | ||||
| Date of publication | 17 Mar 2020 11:25 | ||||
| Institutions | Physics > Institute of Theroretical Physics | ||||
| Identification Number |
| ||||
| Keywords | SHAM ORBITAL ENERGIES; GREENS-FUNCTIONS THEORY; ELECTRON-GAS; IONIZATION-POTENTIALS; EXACT-EXCHANGE; BASIS-SETS; APPROXIMATION; SEMICONDUCTORS; IMPLEMENTATION; BENCHMARKING; | ||||
| Dewey Decimal Classification | 500 Science > 530 Physics | ||||
| Status | Published | ||||
| Refereed | Yes, this version has been refereed | ||||
| Created at the University of Regensburg | Yes | ||||
| Item ID | 42150 |
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