Aspects of Size-Consistency of Orbitally Noninvariant Size-Extensive Multireference Perturbation Theories: A Case Study Using UGA-SSMRPT2 as a Prototype-Reference-Cited by-同舟云学术

Aspects of Size-Consistency of Orbitally Noninvariant Size-Extensive Multireference Perturbation Theories: A Case Study Using UGA-SSMRPT2 as a Prototype

Published:2015-08-04 Issue:9 Volume:11 Page:4129-4145
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Sen Avijit¹,Sen Sangita¹,Mukherjee Debashis¹

Affiliation:

1. Raman Center for Atomic, Molecular and Optical Sciences, Indian Association for the Cultivation of Science, Kolkata 700 032, India

Funder

Science and Engineering Research Board

Department of Science and Technology, Ministry of Science and Technology

Indo-French Centre for the Promotion of Advanced Research

Council of Scientific and Industrial Research

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.5b00457

Reference116 articles.

1. Many-body perturbation theory, coupled-pair many-electron theory, and the importance of quadruple excitations for the correlation problem

2. Many-Body Perturbation Theory and Coupled Cluster Theory for Electron Correlation in Molecules

3. Use of Cluster Expansion Methods in the Open-Shell Correlation Problem

4. Multireference Nature of Chemistry: The Coupled-Cluster View

5. Algebraic connectivity analysis in molecular electronic structure theory II: total exponential formulation of second-quantised correlated methods

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