Dergi makalesi Açık Erişim
Parrish, Robert M.; Burns, Lori A.; Smith, Daniel G. A.; Simmonett, Andrew C.; DePrince, A. Eugene, III; Hohenstein, Edward G.; Bozkaya, Ugur; Sokolov, Alexander Yu.; Di Remigio, Roberto; Richard, Ryan M.; Gonthier, Jerome F.; James, Andrew M.; McAlexander, Harley R.; Kumar, Ashutosh; Saitow, Masaaki; Wang, Xiao; Pritchard, Benjamin P.; Prakash, Verma; Schaefer, Henry F., III; Patkowski, Konrad; Patkowski, Konrad
@article{parrish_robert_m_2017_45127,
author = {Parrish, Robert M. and
Burns, Lori A. and
Smith, Daniel G. A. and
Simmonett, Andrew C. and
DePrince, A. Eugene, III and
Hohenstein, Edward G. and
Bozkaya, Ugur and
Sokolov, Alexander Yu. and
Di Remigio, Roberto and
Richard, Ryan M. and
Gonthier, Jerome F. and
James, Andrew M. and
McAlexander, Harley R. and
Kumar, Ashutosh and
Saitow, Masaaki and
Wang, Xiao and
Pritchard, Benjamin P. and
Prakash, Verma and
Schaefer, Henry F., III and
Patkowski, Konrad and
Patkowski, Konrad},
title = {{PSI4 1.1: An Open-Source Electronic Structure
Program Emphasizing Automation, Advanced
Libraries, and Interoperability}},
journal = {JOURNAL OF CHEMICAL THEORY AND COMPUTATION},
year = 2017,
volume = 13,
number = 7,
pages = {3185-3197},
month = jan,
}
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