| GQCP: The Ghent quantum chemistry package L Lemmens, X De Vriendt, D Tolstykh, T Huysentruyt, P Bultinck, G Acke The Journal of Chemical Physics 155 (8), 2021 | 12 | 2021 |
| Quantifying Delocalization and Static Correlation Errors by Imposing (Spin) Population Redistributions through Constraints on Atomic Domains X De Vriendt, L Lemmens, S De Baerdemacker, P Bultinck, G Acke Journal of Chemical Theory and Computation 17 (11), 6808-6818, 2021 | 7 | 2021 |
| Uncovering phase transitions that underpin the flat-planes in the tilted Hubbard model using subsystems and entanglement measures X De Vriendt, D Van Hende, S De Baerdemacker, P Bultinck, G Acke The Journal of Chemical Physics 156 (24), 2022 | 4 | 2022 |
| Analyzing the behavior of spin phases in external magnetic fields by means of spin-constrained states L Lemmens, X De Vriendt, P Bultinck, G Acke Journal of Chemical Theory and Computation 18 (6), 3364-3376, 2022 | 2 | 2022 |
| Extending Conceptual Density Functional Theory toward First-Order Reduced Density Matrices: An Open Subsystems Viewpoint on the Fukui Matrix G Acke, D Van Hende, X De Vriendt, P Bultinck Journal of Chemical Theory and Computation 19 (16), 5418-5426, 2023 | 1 | 2023 |
| Capturing correlation in the spin frustrated H3-ring using the generator coordinate method and spin-constrained generalised Hartree-Fock states X De Vriendt, J De Vos, S De Baerdemacker, P Bultinck, G Acke Molecular Physics 121 (9-10), e2134831, 2023 | 1 | 2023 |
| Spin-constrained Hartree-Fock and the generator coordinate method for the 2-site Hubbard model S De Baerdemacker, A Ayati, HGA Burton, X De Vriendt, P Bultinck, ... arXiv preprint arXiv:2301.07865, 2023 | | 2023 |
Patrick BultinckGhent University - UGentVerified email at UGent.be
