Quantifying Fluctuations of Average Solvent Environments for Embedding Calculations
Author:
Affiliation:
1. Université de Genève, Départment de Chimie Physique 30, Quai Ernest-Ansermet, CH-1211 Genève 4, Switzerland
2. Ecole Normale Supérieure, Départment de Chimie, UMR 8640, PSL University, Sorbonne University, CNRS, 75005 Paris, France
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.1c01108
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4. Toward a systematic molecular orbital theory for excited states
5. The equation of motion coupled‐cluster method. A systematic biorthogonal approach to molecular excitation energies, transition probabilities, and excited state properties
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