Search

Categories

Theoretical and Computational Chemistry

(1)

Content Types

Working Paper

(1)

Published Date

Over 3 years

(1)

Keywords

nonadiabatic dynamics simulation approaches

Authors

1 results in Keywords: nonadiabatic dynamics simulation approaches

Theoretical and Computational Chemistry

PySurf - A Framework for Database Accelerated Direct Dynamics

Shirin Faraji, Johannes Ehrmaier, Maximilian Menger

Version 1 posted 28 October 2020

223

Downloads