244 citations · 2.2k across the 66 of their papers we have counts for
Showing 2017 · physics.chem-phShow all
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physics.chem-ph2017★ 10 cited
Combining Density Functional Theory and Green's Function Theory: Range-Separated, Non-local, Dynamic, and Orbital-Dependent Hybrid Functional
Alexei A. Kananenka, Dominika Zgid
We present a rigorous framework that combines single-particle Green's function theory with density functional theory based on a separation of electron-electron interactions into sh…
physics.chem-ph2017
Stochastic self-consistent second-order Green's function method for correlation energies of large electronic systems
Daniel Neuhauser, Roi Baer, Dominika Zgid
The second-order Matsubara Green's function method (GF2) is a robust temperature dependent quantum chemistry approach, extending beyond the random-phase approximation. However, til…
physics.chem-ph2017★ 64 cited
Generalized self-energy embedding theory
Tran Nguyen Lan, Dominika Zgid
Ab initio quantum chemistry calculations for systems with large active spaces are notoriously difficult and cannot be successfully tackled by standard methods. In this letter, we g…