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Title: Combining active-space coupled-cluster approaches with moment energy corrections via the CC( P ; Q ) methodology: connected quadruple excitations

Abstract

Not provided.

Authors:
 [1];  [1]; ORCiD logo [2]
  1. Department of Chemistry, Michigan State University, East Lansing, MI, USA
  2. Department of Chemistry, Michigan State University, East Lansing, MI, USA; Department of Physics and Astronomy, Michigan State University, East Lansing, MI, USA
Publication Date:
Research Org.:
Michigan State Univ., East Lansing, MI (United States)
Sponsoring Org.:
USDOE Office of Science (SC)
OSTI Identifier:
1535369
DOE Contract Number:  
FG02-01ER15228
Resource Type:
Journal Article
Journal Name:
Molecular Physics
Additional Journal Information:
Journal Volume: 115; Journal Issue: 21-22; Journal ID: ISSN 0026-8976
Publisher:
Taylor & Francis
Country of Publication:
United States
Language:
English
Subject:
Chemistry; Physics

Citation Formats

Bauman, Nicholas P., Shen, Jun, and Piecuch, Piotr. Combining active-space coupled-cluster approaches with moment energy corrections via the CC( P ; Q ) methodology: connected quadruple excitations. United States: N. p., 2017. Web. doi:10.1080/00268976.2017.1350291.
Bauman, Nicholas P., Shen, Jun, & Piecuch, Piotr. Combining active-space coupled-cluster approaches with moment energy corrections via the CC( P ; Q ) methodology: connected quadruple excitations. United States. doi:10.1080/00268976.2017.1350291.
Bauman, Nicholas P., Shen, Jun, and Piecuch, Piotr. Thu . "Combining active-space coupled-cluster approaches with moment energy corrections via the CC( P ; Q ) methodology: connected quadruple excitations". United States. doi:10.1080/00268976.2017.1350291.
@article{osti_1535369,
title = {Combining active-space coupled-cluster approaches with moment energy corrections via the CC( P ; Q ) methodology: connected quadruple excitations},
author = {Bauman, Nicholas P. and Shen, Jun and Piecuch, Piotr},
abstractNote = {Not provided.},
doi = {10.1080/00268976.2017.1350291},
journal = {Molecular Physics},
issn = {0026-8976},
number = 21-22,
volume = 115,
place = {United States},
year = {2017},
month = {1}
}

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  • DOI: 10.1063/1.1677527

The influence of polarization functions on molecular orbital hydrogenation energies
journal, January 1973

  • Hariharan, P. C.; Pople, J. A.
  • Theoretica Chimica Acta, Vol. 28, Issue 3
  • DOI: 10.1007/BF00533485