Using Kohn−Sham Orbitals in Symmetry-Adapted Perturbation Theory to Investigate Intermolecular Interactions
Author:
Affiliation:
1. Army Research Laboratory, AMSRL-WM-BD, Aberdeen Proving Ground, Maryland 21005-5006
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp003883p
Reference67 articles.
1. Inhomogeneous Electron Gas
2. Self-Consistent Equations Including Exchange and Correlation Effects
3. Approximate density functional theory as a practical tool in molecular energetics and dynamics
4. Density-Functional Theory of the Electronic Structure of Molecules
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