| NECI: N-Electron Configuration Interaction with an emphasis on state-of-the-art stochastic methods K Guther, RJ Anderson, NS Blunt, NA Bogdanov, D Cleland, N Dattani, ... The Journal of chemical physics 153 (3), 2020 | 77 | 2020 |
| Similarity transformation of the electronic Schrödinger equation via Jastrow factorization AJ Cohen, H Luo, K Guther, W Dobrautz, DP Tew, A Alavi The Journal of Chemical Physics 151 (6), 2019 | 59 | 2019 |
| The adaptive shift method in full configuration interaction quantum Monte Carlo: Development and applications K Ghanem, K Guther, A Alavi The Journal of Chemical Physics 153 (22), 2020 | 38 | 2020 |
| Resolution of Low-Energy States in Spin-Exchange Transition-Metal Clusters: Case Study of Singlet States in [Fe(III)4S4] Cubanes G Li Manni, W Dobrautz, NA Bogdanov, K Guther, A Alavi The Journal of Physical Chemistry A 125 (22), 4727-4740, 2021 | 28 | 2021 |
| Binding curve of the beryllium dimer using similarity-transformed FCIQMC: Spectroscopic accuracy with triple-zeta basis sets K Guther, AJ Cohen, H Luo, A Alavi The Journal of Chemical Physics 155 (1), 2021 | 27 | 2021 |
| Time propagation and spectroscopy of Fermionic systems using a stochastic technique K Guther, W Dobrautz, O Gunnarsson, A Alavi Physical review letters 121 (5), 056401, 2018 | 26 | 2018 |
| Chemical insights into the electronic structure of Fe (II) porphyrin using FCIQMC, DMRG, and generalized active spaces O Weser, L Freitag, K Guther, A Alavi, G Li Manni International Journal of Quantum Chemistry 121 (3), e26454, 2021 | 25 | 2021 |
| Stochastic Generalized Active Space Self-Consistent Field: Theory and Application O Weser, K Guther, K Ghanem, G Li Manni Journal of chemical theory and computation 18 (1), 251-272, 2021 | 21 | 2021 |
| Ising anyonic topological phase of interacting fermions in one dimension K Guther, N Lang, HP Büchler Physical Review B 96 (12), 121109, 2017 | 15 | 2017 |
| Foundation of Multi‐Configurational Quantum Chemistry G Li Manni, K Guther, D Ma, W Dobrautz Quantum Chemistry and Dynamics of Excited States: Methods and Applications …, 2020 | 9 | 2020 |
| A real-time algorithm for FCIQMC KS Guther | | 2020 |
| Topological edge states in a one-dimensional ladder system KS Guther, HP Büchler, M Daghofer | | 2016 |
