Search

Categories

Physical Chemistry

(2)

Theoretical and Computational Chemistry

(2)

Content Types

Working Paper

(2)

Published Date

Last 3 years

(2)

Last 12 months

(1)

Last 6 months

(1)

Keywords

Authors

Johannes Henrichsmeyer

2 results in Authors: Johannes Henrichsmeyer

Theoretical and Computational Chemistry

What is the exchange-repulsion energy? Insight by partitioning into physically meaningful contributions

Johannes Henrichsmeyer, Michael Thelen, Reinhold F. Fink

Version 1 posted 12 August 2024

139

Downloads

Theoretical and Computational Chemistry

Rationalizing aggregate structures with orbital contributions to the exchange-repulsion energy

Johannes Henrichsmeyer, Michael Thelen, Marc Bröckel, Mariam Fadel, Stefan Behnle, Majda Sekkal Rahal, Reinhold Fink

Version 1 posted 15 December 2022

152

Downloads