Dispersion interactions in exciton-localised states. Theory and applications to π − π* and n − π* excited states.

Presentation . 2022

License: CC BY

Data sources: Datacite

Presentation . 2022

License: CC BY

Data sources: Datacite

Other literature type . 2022

License: CC BY

Data sources: ZENODO

descriptionPublicationkeyboard_double_arrow_right Presentation , Other literature type 10 Jun 2022Publisher:ZenodoFunded by:EC | TREX

Authors: Michał Hapka; Katarzyna Pernal;

Abstract

Presentation on dispersion interactions in exciton-localized states given at the OpenMolcas developers' workshop, June 2022.

{"references": ["M. R. Jangrouei et al, J. Chem. Theory Comput. 2022, https://doi.org/10.1021/acs.jctc.2c00221"]}

Related Organizations

Keywords

symmetry-adapted perturbation theory, noncovalent interactions, excited states

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