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1 Ergebnisse
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Accuracy of DLPNO-CCSD(T): Effect of Basis Set and System S..:
Isolde Sandler (8909714)
;
Junbo Chen (407359)
;
Mackenzie Taylor (288114)
..
https://figshare.com/articles/journal_contribution/Accuracy_of_DLPNO-CCSD_T_Effect_of_Basis_Set_and_System_Size/13816289. , 2021
Link:
https://doi.org/10.1021/acs.jpca.0c11270.s001
RT Journal T1 <Title>Accuracy of DLPNO-CCSD(T): Effect of Basis Set and System Size</Title> UL https://suche.suub.uni-bremen.de/peid=base-ftsmithonian:oai:figshare.com:article_13816289&Exemplar=1&LAN=DE A1 Isolde Sandler (8909714) A1 Junbo Chen (407359) A1 Mackenzie Taylor (288114) A1 Shaleen Sharma (10120118) A1 Junming Ho (1342764) YR 2021 K1 Biophysics K1 Biochemistry K1 Sociology K1 Infectious Diseases K1 Computational Biology K1 Biological Sciences not elsewhere classified K1 Chemical Sciences not elsewhere classified K1 calculation K1 chlorine atom transfer reactions K1 DLPNO K1 CCSD K1 reaction energies K1 barrier K1 atom transfer reactions K1 anion binding affinities K1 system size K1 DLPNO-CCSD JF https://figshare.com/articles/journal_contribution/Accuracy_of_DLPNO-CCSD_T_Effect_of_Basis_Set_and_System_Size/13816289 LK http://dx.doi.org/https://doi.org/10.1021/acs.jpca.0c11270.s001 DO https://doi.org/10.1021/acs.jpca.0c11270.s001 SF ELIB - SuUB Bremen
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