Stephan Irle
3PUBLICATIONS
42CO-AUTHORS
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Publications (3)
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|Apr 24, 2020
Recent developments in the general atomic and molecular electronic structure system.Giuseppe M J Barca, Colleen Bertoni, Laura Carrington
|Apr 04, 2020
DFTB+, a software package for efficient approximate density functional theory based atomistic simulations.B Hourahine, B Aradi, V Blum
|Dec 12, 2019
Nonadiabatic excited-state intramolecular proton transfer in 3-hydroxyflavone: S2 state involvement via multi-mode effect.Neethu Anand, Kai Welke, Stephan Irle
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