ATTO2019 Registration to Scientific Sessions

Ab Initio Approach to Ultrafast Spectroscopy with Stochastic Time-Dependent Density Functional Theory and Gauge-Including Projector Augmented Wave Method

3 Jul 2019, 18:00

2h

University of Szeged Congress Centre

poster Poster session 2

Speaker

Stanislav Kruchinin (Universität Wien)

Description

We extend the gauge-including projector augmented wave method to the case of time-dependent electric fields of arbitrary strength and present its implementation in the VASP code. Interaction with an environment is described within the stochastic approach.