| Global optimization of parameters in the reactive force field ReaxFF for SiOH HR Larsson, ACT van Duin, B Hartke Journal of computational chemistry 34 (25), 2178-2189, 2013 | 109 | 2013 |
| The chromium dimer: closing a chapter of quantum chemistry HR Larsson, H Zhai, CJ Umrigar, GKL Chan J. Am. Chem. Soc., 10.1021/jacs.2c06357, 2022 | 63 | 2022 |
| Computing vibrational eigenstates with tree tensor network states (TTNS) HR Larsson The Journal of Chemical Physics 151 (20), 204102, 2019 | 59 | 2019 |
| Efficient molecular quantum dynamics in coordinate and phase space using pruned bases HR Larsson, B Hartke, DJ Tannor The Journal of chemical physics 145 (20), 204108, 2016 | 42 | 2016 |
| Self-probing spectroscopy of XUV photo-ionization dynamics in atoms subjected to a strong-field environment D Azoury, M Krüger, G Orenstein, HR Larsson, S Bauch, BD Bruner, ... Nature Communications 8 (1), 1453, 2017 | 36 | 2017 |
| Dynamical pruning of the multiconfiguration time-dependent Hartree (DP-MCTDH) method: An efficient approach for multidimensional quantum dynamics HR Larsson, DJ Tannor The Journal of chemical physics 147 (4), 044103, 2017 | 31 | 2017 |
| Block2: a comprehensive open source framework to develop and apply state-of-the-art DMRG algorithms in electronic structure and beyond H Zhai, HR Larsson, S Lee, ZH Cui, T Zhu, C Sun, L Peng, R Peng, K Liao, ... The Journal of Chemical Physics 159 (23), 2023 | 30 | 2023 |
| Correlation effects in strong-field ionization of heteronuclear diatomic molecules HR Larsson, S Bauch, LK Sørensen, M Bonitz Physical Review A 93 (1), 013426, 2016 | 25 | 2016 |
| Matrix product states with large sites HR Larsson, H Zhai, K Gunst, GKL Chan Journal of Chemical Theory and Computation 18 (2), 749-762, 2022 | 20 | 2022 |
| Quantum dynamics in phase space using projected von Neumann bases S Machnes, E Assémat, HR Larsson, DJ Tannor The Journal of Physical Chemistry A 120 (19), 3296-3308, 2016 | 19 | 2016 |
| State-resolved infrared spectrum of the protonated water dimer: Revisiting the characteristic proton transfer doublet peak HR Larsson, M Schröder, R Beckmann, F Brieuc, C Schran, D Marx, ... Chem. Sci., DOI 10.1039/D2SC03189B, 2022 | 13 | 2022 |
| Minimal matrix product states and generalizations of mean-field and geminal wavefunctions HR Larsson, CA Jiménez-Hoyos, GKL Chan Journal of Chemical Theory and Computation 16 (8), 5057-5066, 2020 | 11 | 2020 |
| Fitting reactive force fields using genetic algorithms HR Larsson, B Hartke Comput. Method Mater. Sci 13 (1), 2013 | 11 | 2013 |
| Phase‐Space Versus Coordinate‐Space Methods: Prognosis for Large Quantum Calculations D Tannor, S Machnes, E Assémat, HR Larsson Advances in Chemical Physics 163, 273-323, 2018 | 7 | 2018 |
| Resonance dynamics of DCO () simulated with the dynamically pruned discrete variable representation (DP-DVR) HR Larsson, J Riedel, J Wei, F Temps, B Hartke The Journal of chemical physics 148 (20), 204309, 2018 | 6 | 2018 |
| The time-dependent generalized active space configuration interaction approach to correlated ionization dynamics of diatomic molecules S Bauch, HR Larsson, C Hinz, M Bonitz Journal of Physics: Conference Series 696 (1), 012008, 2016 | 4 | 2016 |
| A tensor network view of multilayer multiconfiguration time-dependent Hartree methods HR Larsson Molecular Physics, e2306881, 2024 | 3 | 2024 |
| Comparing the performance of time-dependent-Schrödinger-equation solvers for the 800-nm, one-electron-atom, strong-field problem BD Esry, Y Wang, D Ursrey, HR Larsson, DJ Tannor, N Douguet, ... APS Division of Atomic, Molecular and Optical Physics Meeting Abstracts 2018 …, 2018 | 3 | 2018 |
| Control of concerted back-to-back double ionization dynamics in helium HR Larsson, DJ Tannor The Journal of Chemical Physics 155 (14), 144105, 2021 | 1 | 2021 |
| 2500 vibronic eigenstates of the NO radical HR Larsson, A Viel arXiv preprint arXiv:2407.03398, 2024 | | 2024 |
Garnet Kin-Lic ChanDivision of Chemistry and Chemical Engineering, California Institute of TechnologyVerified email at caltech.edu
