Optimization of large determinant expansions in quantum Monte Carlo A Ammar, E Giner, A Scemama Journal of Chemical Theory and Computation 18 (9), 5325-5336, 2022 | 13 | 2022 |
TREXIO: A file format and library for quantum chemistry E Posenitskiy, VG Chilkuri, A Ammar, M Hapka, K Pernal, R Shinde, ... The Journal of chemical physics 158 (17), 2023 | 9 | 2023 |
Extension of selected configuration interaction for transcorrelated methods A Ammar, A Scemama, E Giner The Journal of Chemical Physics 157 (13), 2022 | 9 | 2022 |
Fitting continuum wavefunctions with complex Gaussians: Computation of ionization cross sections A Ammar, A Leclerc, LU Ancarani Journal of Computational Chemistry 41 (27), 2365-2377, 2020 | 6 | 2020 |
Can Handle Multireference Systems? A Ammar, A Marie, M Rodríguez-Mayorga, HGA Burton, PF Loos arXiv preprint arXiv:2401.03745, 2024 | 3 | 2024 |
The Approximation: A Quantum Chemistry Perspective A Marie, A Ammar, PF Loos arXiv preprint arXiv:2311.05351, 2023 | 3 | 2023 |
Biorthonormal Orbital Optimization with a Cheap Core-Electron-Free Three-Body Correlation Factor for Quantum Monte Carlo and Transcorrelation A Ammar, A Scemama, E Giner Journal of Chemical Theory and Computation 19 (15), 4883-4896, 2023 | 3 | 2023 |
A complex Gaussian approach to molecular photoionization A Ammar, LU Ancarani, A Leclerc Journal of Computational Chemistry 42 (32), 2294-2305, 2021 | 3 | 2021 |
Multicenter integrals involving complex Gaussian-type functions A Ammar, A Leclerc, LU Ancarani Advances in Quantum Chemistry 83, 287-304, 2021 | 2 | 2021 |
Cumulant Green's function methods for molecules PF Loos, A Marie, A Ammar arXiv preprint arXiv:2402.16414, 2024 | 1 | 2024 |
Calculation of electron-impact and photo-ionization cross sections of methane using analytical Gaussian integrals A Ammar, A Leclerc, LU Ancarani arXiv preprint arXiv:2312.11695, 2023 | 1 | 2023 |
Transcorrelated selected configuration interaction in a bi-orthonormal basis and with a cheap three-body correlation factor A Ammar, A Scemama, E Giner The Journal of Chemical Physics 159 (11), 2023 | 1 | 2023 |
Représentation des états du continuum par des gaussiennes complexes: application aux processus d’ionisation atomiques et moléculaires A Ammar Université de Lorraine, 2020 | 1 | 2020 |
Go Green: Selected Configuration Interaction as a More Sustainable Alternative for High Accuracy PF Loos, Y Damour, A Ammar, M Caffarel, F Kossoski, A Scemama arXiv preprint arXiv:2402.13111, 2024 | | 2024 |
On the use of complex GTOs for the evaluation of radial integrals involving oscillating functions A Ammar, A Leclerc, LU Ancarani Academic Press, 2023 | | 2023 |
Ionization of molecules using a Gaussian representation of the continuum states LU Ancarani, A Leclerc, A Ammar APS Annual Gaseous Electronics Meeting Abstracts, GT2. 004, 2023 | | 2023 |
Supporting Information for “The GW Approximation: A Quantum Chemistry Perspective” A Marie, A Ammar, PF Loos | | |
DE LORRAINE A AMMAR | | |