Efficient Reduced-Scaling Second-Order Møller–Plesset Perturbation Theory with Cholesky-Decomposed Densities and an Attenuated Coulomb Metric
Author:
Affiliation:
1. Chair of Theoretical Chemistry, Department of Chemistry, University of Munich (LMU), Butenandtstrasse 7, 81377 Munich, Germany
Funder
Deutsche Forschungsgemeinschaft
Studienstiftung des Deutschen Volkes
Max-Planck-Gesellschaft
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.0c00600
Reference67 articles.
1. Note on an Approximation Treatment for Many-Electron Systems
2. Møller-Plesset perturbation theory: from small molecule methods to methods for thousands of atoms
3. Improved second-order Møller–Plesset perturbation theory by separate scaling of parallel- and antiparallel-spin pair correlation energies
4. Scaled opposite-spin second order Møller–Plesset correlation energy: An economical electronic structure method
5. Density-Functional Theory of the Electronic Structure of Molecules
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