| The HANDE-QMC project: open-source stochastic quantum chemistry from the ground state up JS Spencer, NS Blunt, S Choi, J Etrych, MA Filip, WMC Foulkes, ... Journal of chemical theory and computation 15 (3), 1728-1742, 2019 | 50 | 2019 |
| Semiclassical approach to photophysics beyond kasha’s rule and vibronic spectroscopy beyond the condon approximation. The case of azulene A Prlj, T Begusic, ZT Zhang, GC Fish, M Wehrle, T Zimmermann, S Choi, ... Journal of chemical theory and computation 16 (4), 2617-2626, 2020 | 40 | 2020 |
| Efficient geometric integrators for nonadiabatic quantum dynamics. II. The diabatic representation J Roulet, S Choi, J Vaníček The Journal of chemical physics 150 (20), 2019 | 27 | 2019 |
| Fluid fermionic fragments for optimizing quantum measurements of electronic Hamiltonians in the variational quantum eigensolver S Choi, I Loaiza, AF Izmaylov Quantum 7, 889, 2023 | 26 | 2023 |
| Improving quantum measurements by introducing “ghost” pauli products S Choi, TC Yen, AF Izmaylov Journal of Chemical Theory and Computation 18 (12), 7394-7402, 2022 | 25 | 2022 |
| Efficient geometric integrators for nonadiabatic quantum dynamics. I. The adiabatic representation S Choi, J Vaníček The Journal of chemical physics 150 (20), 2019 | 24 | 2019 |
| How important are the residual nonadiabatic couplings for an accurate simulation of nonadiabatic quantum dynamics in a quasidiabatic representation? S Choi, J Vaníček The Journal of Chemical Physics 154 (12), 2021 | 12 | 2021 |
| A time-reversible integrator for the time-dependent Schrödinger equation on an adaptive grid S Choi, J Vaníček The Journal of chemical physics 151 (23), 2019 | 12 | 2019 |
| Measurement optimization techniques for excited electronic states in near-term quantum computing algorithms S Choi, AF Izmaylov Journal of Chemical Theory and Computation 19 (11), 3184-3193, 2023 | 9 | 2023 |
| High-order geometric integrators for representation-free Ehrenfest dynamics S Choi, J Vaníček The Journal of Chemical Physics 155 (12), 2021 | 8 | 2021 |
| Which form of the molecular Hamiltonian is the most suitable for simulating the nonadiabatic quantum dynamics at a conical intersection? S Choi, J Vaníček The Journal of Chemical Physics 153 (21), 2020 | 7 | 2020 |
| Probing Quantum Efficiency: Exploring System Hardness in Electronic Ground State Energy Estimation S Choi, I Loaiza, RA Lang, LA Martínez-Martínez, AF Izmaylov arXiv preprint arXiv:2311.00129, 2023 | 1 | 2023 |
| High-order geometric integrators for nonadiabatic molecular quantum dynamics and their applications to explore conical intersections S Choi EPFL, 2022 | | 2022 |
