Towards the solution of the many-electron problem in real materials: Equation of state of the hydrogen chain with state-of-the-art many-body methods M Motta, DM Ceperley, GKL Chan, JA Gomez, E Gull, S Guo, ... Physical Review X 7 (3), 031059, 2017 | 218 | 2017 |
The density matrix renormalization group self-consistent field method: Orbital optimization with the density matrix renormalization group method in the active space D Zgid, M Nooijen The Journal of chemical physics 128 (14), 144116, 2008 | 189 | 2008 |
Dynamical mean-field theory from a quantum chemical perspective D Zgid, GK Chan The Journal of chemical physics 134 (9), 2011 | 135 | 2011 |
Truncated configuration interaction expansions as solvers for correlated quantum impurity models and dynamical mean-field theory D Zgid, E Gull, GKL Chan Physical Review B 86 (16), 165128, 2012 | 131 | 2012 |
On the spin and symmetry adaptation of the density matrix renormalization group method D Zgid, M Nooijen The Journal of chemical physics 128 (1), 014107, 2008 | 116 | 2008 |
Communication: The description of strong correlation within self-consistent Green's function second-order perturbation theory JJ Phillips, D Zgid The Journal of chemical physics 140 (24), 241101, 2014 | 103 | 2014 |
Systematically improvable multiscale solver for correlated electron systems AA Kananenka, E Gull, D Zgid Physical Review B 91 (12), 121111, 2015 | 97 | 2015 |
Obtaining the two-body density matrix in the density matrix renormalization group method D Zgid, M Nooijen The Journal of chemical physics 128 (14), 144115, 2008 | 93 | 2008 |
Interaction of NH (X Σ) with He: Potential energy surface, bound states, and collisional Zeeman relaxation H Cybulski, RV Krems, HR Sadeghpour, A Dalgarno, J Kłos, ... The Journal of chemical physics 122 (9), 094307, 2005 | 91 | 2005 |
Direct comparison of many-body methods for realistic electronic Hamiltonians KT Williams, Y Yao, J Li, L Chen, H Shi, M Motta, C Niu, U Ray, S Guo, ... Physical Review X 10 (1), 011041, 2020 | 89 | 2020 |
Self-consistent second-order Green’s function perturbation theory for periodic systems AA Rusakov, D Zgid The Journal of chemical physics 144 (5), 054106, 2016 | 85 | 2016 |
Low-temperature collisions of NH (X 3 Σ−) molecules with He atoms in a magnetic field: An ab initio study RV Krems, HR Sadeghpour, A Dalgarno, D Zgid, J Kłos, G Chałasiński Physical Review A 68 (5), 051401, 2003 | 85 | 2003 |
Communication: Towards ab initio self-energy embedding theory in quantum chemistry TN Lan, AA Kananenka, D Zgid The Journal of chemical physics 143 (24), 241102, 2015 | 83 | 2015 |
The density matrix renormalization group in quantum chemistry GKL Chan, D Zgid Annual Reports in Computational Chemistry 5, 149-162, 2009 | 81 | 2009 |
A study of cumulant approximations to -electron valence multireference perturbation theory D Zgid, D Ghosh, E Neuscamman, GKL Chan The Journal of chemical physics 130 (19), 194107, 2009 | 80 | 2009 |
Finite temperature quantum embedding theories for correlated systems D Zgid, E Gull New Journal of Physics 19 (2), 023047, 2017 | 77 | 2017 |
Generalized self-energy embedding theory TN Lan, D Zgid The Journal of Physical Chemistry Letters 8 (10), 2200-2205, 2017 | 58 | 2017 |
Self-energy embedding theory (SEET) for periodic systems AA Rusakov, S Iskakov, L Tran Nguyen, D Zgid Journal of chemical theory and computation 15 (1), 229-240, 2019 | 56 | 2019 |
Rigorous Ab Initio Quantum Embedding for Quantum Chemistry Using Green’s Function Theory: Screened Interaction, Nonlocal Self-Energy Relaxation, Orbital Basis, and Chemical … T Nguyen Lan, AA Kananenka, D Zgid Journal of Chemical Theory and Computation 12 (10), 4856-4870, 2016 | 53 | 2016 |
Exploring connections between statistical mechanics and Green’s functions for realistic systems: Temperature dependent electronic entropy and internal energy from a self … AR Welden, AA Rusakov, D Zgid The Journal of chemical physics 145 (20), 204106, 2016 | 52 | 2016 |