Bond energy decomposition analysis for subsystem density functional theory
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4793629
Reference105 articles.
1. The World of Non-Covalent Interactions: 2006
2. van der Waals Molecules III: Introduction
3. Magnitude and Physical Origin of Intermolecular Interactions of Aromatic Molecules: Recent Progress of Computational Studies
4. Interactions with Aromatic Rings
5. Estimates of the Ab Initio Limit for π−π Interactions: The Benzene Dimer
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