Externally Corrected CCSD with Renormalized Perturbative Triples (R-ecCCSD(T)) and the Density Matrix Renormalization Group and Selected Configuration Interaction External Sources-Reference-Cited by-同舟云学术

Externally Corrected CCSD with Renormalized Perturbative Triples (R-ecCCSD(T)) and the Density Matrix Renormalization Group and Selected Configuration Interaction External Sources

Published:2021-05-21 Issue:6 Volume:17 Page:3414-3425
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Lee Seunghoon¹^ORCID,Zhai Huanchen¹^ORCID,Sharma Sandeep²^ORCID,Umrigar C. J.³,Chan Garnet Kin-Lic¹

Affiliation:

1. Division of Chemistry and Chemical Engineering, California Institute of Technology, Pasadena, California 91125, United States

2. Department of Chemistry, The University of Colorado at Boulder, Boulder, Colorado 80302, United States

3. Laboratory of Atomic and Solid State Physics, Cornell University, Ithaca, New York 14853, United States

Funder

Division of Chemistry

Air Force Office of Scientific Research

Alfred P. Sloan Foundation

Simons Foundation

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.1c00205

Reference122 articles.

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5. Electronic landscape of the P-cluster of nitrogenase as revealed through many-electron quantum wavefunction simulations

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