Mannouch, J. Hamburg Center for Ultrafast Imaging, Universität Hamburg ; Theory Group, Theory Department, Max Planck Institute for the Structure and Dynamics of Matter, Max Planck Society;
https://arxiv.org/abs/2403.10627 (Preprint)
https://doi.org/10.1063/5.0208575 (Verlagsversion)
244112_1_5.0208575.pdf (Verlagsversion), 7MB
benzene-5d-diabatic-populations-diabatic-init.txt (Ergänzendes Material), 235KB
Lawrence, J. E., Mannouch, J., & Richardson, J. O. (2024). A size-consistent multi-state mapping approach to surface hopping. The Journal of Chemical Physics, 160(24): 244112. doi:10.1063/5.0208575.