Data for: On the single-Hessian Gaussian wavepacket dynamics
Data for publication: D. Barbiero, J. J. L. Vanicek, On the single-Hessian Gaussian wavepacket dynamics.
Contains data for all figures of the abovementioned publication, including simulated photoelectron spectrum of difluorocarbene anion, simulated absorption spectrum of methylamine, numerical analysis of the geometric properties of single-Hessian Gaussian wavepacket dynamics, and numerical analysis of the geometric integrators developed for the single-Hessian Gaussian wavepacket dynamics.
École Polytechnique Fédérale de Lausanne
École Polytechnique Fédérale de Lausanne
2026-02-11
v1
CC BY
| Funder | Funding(s) | Grant NO | Grant URL |
Swiss National Science Foundation | Hagedorn wavepacket dynamics for vibronic spectroscopy | 10005187 | |
| Relation | Related work | URL/DOI |
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