Comprehensive Benchmark Results for the Domain Based Local Pair Natural Orbital Coupled Cluster Method (DLPNO-CCSD(T)) for Closed- and Open-Shell Systems-Reference-Cited by-同舟云学术

Comprehensive Benchmark Results for the Domain Based Local Pair Natural Orbital Coupled Cluster Method (DLPNO-CCSD(T)) for Closed- and Open-Shell Systems

Published:2019-12-16 Issue:1 Volume:124 Page:90-100
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Liakos Dimitrios G.¹^ORCID,Guo Yang¹,Neese Frank¹^ORCID

Affiliation:

1. Department of Molecular Theory and Spectroscopy, Max Planck Institut für Kohlenforschung, Kaiser-Wilhelm Platz 1, 45470 Mülheim an der Ruhr, Germany

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

http://pubs.acs.org/doi/pdf/10.1021/acs.jpca.9b05734

Reference63 articles.

1. Efficient and accurate local single reference correlation methods for high-spin open-shell molecules using pair natural orbitals

2. Weak Molecular Interactions Studied with Parallel Implementations of the Local Pair Natural Orbital Coupled Pair and Coupled Cluster Methods

3. Efficient and accurate local approximations to coupled-electron pair approaches: An attempt to revive the pair natural orbital method

4. Accurate Theoretical Chemistry with Coupled Pair Models

5. Efficient and accurate approximations to the local coupled cluster singles doubles method using a truncated pair natural orbital basis

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