Importance of the Intermolecular Pauli Repulsion in Embedding Calculations for Molecular Properties: The Case of Excitation Energies for a Chromophore in Hydrogen-Bonded Environments

Title
Importance of the Intermolecular Pauli Repulsion in Embedding Calculations for Molecular Properties: The Case of Excitation Energies for a Chromophore in Hydrogen-Bonded Environments
Authors
Keywords
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Journal
JOURNAL OF PHYSICAL CHEMISTRY A
Volume 115, Issue 35, Pages 10018-10026
Publisher
American Chemical Society (ACS)
Online
2011-07-19
DOI
10.1021/jp203192g

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