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1 Ergebnisse
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Quantum Chemistry Common Driver and Databases (QCDB) and Qu..:
Smith, Daniel G. A
;
Lolinco, Annabelle T
;
Glick, Zachary L
...
https://github.com/MolSSI/QCElemental. , 2021
Link:
https://doi.org/10.1063/5.0059356
RT Journal T1
Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programs
UL https://suche.suub.uni-bremen.de/peid=base-ftcaltechauth:oai:authors.library.caltech.edu:b0b99-bja27&Exemplar=1&LAN=DE A1 Smith, Daniel G. A A1 Lolinco, Annabelle T A1 Glick, Zachary L A1 Lee, Jiyoung A1 Alenaizan, Asem A1 Barnes, Taylor A A1 Borca, Carlos H A1 Di Remigio, Roberto A1 Dotson, David L A1 Ehlert, Sebastian A1 Heide, Alexander G A1 Herbst, Michael F A1 Hermann, Jan A1 Hicks, Colton B A1 Horton, Joshua T A1 Hurtado, Adrian G A1 Kraus, Peter A1 Kruse, Holger A1 Lee, Sebastian J. R A1 Misiewicz, Jonathon P A1 Naden, Levi N A1 Ramezanghorbani, Farhad A1 Scheurer, Maximilian A1 Schriber, Jeffrey B A1 Simmonett, Andrew C A1 Steinmetzer, Johannes A1 Wagner, Jeffrey R A1 Ward, Logan A1 Welborn, Matthew A1 Altarawy, Doaa A1 Anwar, Jamshed A1 Chodera, John D A1 Dreuw, Andreas A1 Kulik, Heather J A1 Liu, Fang A1 Martínez, Todd J A1 Matthews, Devin A A1 Schaefer, Henry F A1 Å poner, Jiří A1 Turney, Justin M A1 Wang, Lee-Ping A1 De Silva, Nuwan A1 King, Rollin A A1 Stanton, John F A1 Gordon, Mark S A1 Windus, Theresa L A1 Sherrill, C. David A1 Burns, Lori A PB American Institute of Physics YR 2021 K1 Physical and Theoretical Chemistry K1 General Physics and Astronomy JF https://github.com/MolSSI/QCElemental LK http://dx.doi.org/https://doi.org/10.1063/5.0059356 DO https://doi.org/10.1063/5.0059356 SF ELIB - SuUB Bremen
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