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Title: Explicitly correlated coupled cluster method for accurate treatment of open-shell molecules with hundreds of atoms

Authors:
ORCiD logo [1]; ORCiD logo [2]; ORCiD logo [1]
+ Show Author Affiliations
  1. Department of Chemistry, Virginia Tech, Blacksburg, Virginia 24061, USA
  2. Max-Planck-Institut für Kohlenforschung, Kaiser-Wilhelm-Platz 1, D-45470 Mülheim an der Ruhr, Germany
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1657628
Grant/Contract Number:  
17-SC-20-SC
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Name: Journal of Chemical Physics Journal Volume: 153 Journal Issue: 9; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Country of Publication:
United States
Language:
English

Citation Formats

Kumar, Ashutosh, Neese, Frank, and Valeev, Edward F. Explicitly correlated coupled cluster method for accurate treatment of open-shell molecules with hundreds of atoms. United States: N. p., 2020. Web. doi:10.1063/5.0012753.
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Kumar, Ashutosh, Neese, Frank, & Valeev, Edward F. Explicitly correlated coupled cluster method for accurate treatment of open-shell molecules with hundreds of atoms. United States. https://doi.org/10.1063/5.0012753
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Kumar, Ashutosh, Neese, Frank, and Valeev, Edward F. Mon . "Explicitly correlated coupled cluster method for accurate treatment of open-shell molecules with hundreds of atoms". United States. https://doi.org/10.1063/5.0012753.
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@article{osti_1657628,
title = {Explicitly correlated coupled cluster method for accurate treatment of open-shell molecules with hundreds of atoms},
author = {Kumar, Ashutosh and Neese, Frank and Valeev, Edward F.},
abstractNote = {},
doi = {10.1063/5.0012753},
journal = {Journal of Chemical Physics},
number = 9,
volume = 153,
place = {United States},
year = {2020},
month = {9}
}
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