A Comparison of the Interacting Quantum Atoms (IQA) Analysis of the Two‐Particle Density‐Matrices of MP4SDQ and CCSD
Author:
Affiliation:
1. Manchester Institute of Biotechnology The University of Manchester M1 7DN Manchester UK
2. Department of Chemistry The University of Manchester M13 9PL Manchester UK
Funder
Engineering and Physical Sciences Research Council
Publisher
Wiley
Subject
Inorganic Chemistry
Link
https://onlinelibrary.wiley.com/doi/pdf/10.1002/zaac.202000169
Reference28 articles.
1. Interacting quantum atoms (IQA) energy partition: The employing exact response CCSD density to benchmark density matrix functional approximations
2. Partitioning dynamic electron correlation energy: Viewing Møller-Plesset correlation energies through Interacting Quantum Atom (IQA) energy partitioning
3. Contributions of IQA electron correlation in understanding the chemical bond and non-covalent interactions
4. Dynamical correlation within the Interacting Quantum Atoms method through coupled cluster theory
5. Where Does Electron Correlation Lie? Some Answers from a Real Space Partition
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