NQCDynamics.jl: A Julia package for nonadiabatic quantum classical molecular dynamics in the condensed phase. (2022)
Attributed to:
Computational prediction of hot-electron chemistry: Towards electronic control of catalysis
funded by
FLF
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1063/5.0089436
PubMed Identifier: 35525649
Publication URI: http://europepmc.org/abstract/MED/35525649
Type: Journal Article/Review
Volume: 156
Parent Publication: The Journal of chemical physics
Issue: 17
ISSN: 0021-9606