A new method to calculate ultrafast electron dynamics in molecules based on matrix product states
Abstract
We propose a new method to describe electron dynamics in molecules on the scale of femtoseconds. It is based on factorizing the electronic wave function into a matrix product state and using this factorization to solve the time dependent Schrodinger equation.
- Publication:
-
European Physical Journal Web of Conferences
- Pub Date:
- July 2019
- DOI:
- 10.1051/epjconf/201920503009
- Bibcode:
- 2019EPJWC.20503009F