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Schäfer, Ansgar, Horn, Hans, Ahlrichs, Reinhart (1992) Fully optimized contracted Gaussian basis sets for atoms Li to Kr. The Journal of Chemical Physics, 97 (4). 2571-2577 doi:10.1063/1.463096

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Reference TypeJournal (article/letter/editorial)
TitleFully optimized contracted Gaussian basis sets for atoms Li to Kr
JournalThe Journal of Chemical Physics
AuthorsSchäfer, AnsgarAuthor
Horn, HansAuthor
Ahlrichs, ReinhartAuthor
Year1992 (August 15)Volume97
Issue4
PublisherAIP Publishing
DOIdoi:10.1063/1.463096Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID2199089Long-form Identifiermindat:1:5:2199089:0
GUID0
Full ReferenceSchäfer, Ansgar, Horn, Hans, Ahlrichs, Reinhart (1992) Fully optimized contracted Gaussian basis sets for atoms Li to Kr. The Journal of Chemical Physics, 97 (4). 2571-2577 doi:10.1063/1.463096
Plain TextSchäfer, Ansgar, Horn, Hans, Ahlrichs, Reinhart (1992) Fully optimized contracted Gaussian basis sets for atoms Li to Kr. The Journal of Chemical Physics, 97 (4). 2571-2577 doi:10.1063/1.463096
In(1992, August) The Journal of Chemical Physics Vol. 97 (4) AIP Publishing

See Also

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Schäfer, Ansgar, Huber, Christian, Ahlrichs, Reinhart (1994) Fully optimized contracted Gaussian basis sets of triple zeta valence quality for atoms Li to Kr. The Journal of Chemical Physics, 100 (8). 5829-5835 doi:10.1063/1.467146
Ahlrichs, Reinhart, May, Klaus (2000) Contracted all-electron Gaussian basis sets for atoms Rb to Xe. Physical Chemistry Chemical Physics, 2 (5). 943-945 doi:10.1039/a908859h
Weigend, Florian, Furche, Filipp, Ahlrichs, Reinhart (2003) Gaussian basis sets of quadruple zeta valence quality for atoms H–Kr. The Journal of Chemical Physics, 119 (24). 12753-12762 doi:10.1063/1.1627293
Schneider, Uwe, Ahlrichs, Reinhart, Horn, Hans, Schäfer, Ansgar (1992) Ab-initio-Untersuchungen zu Struktur und Stabilität von [R3SiAl]4, R = H, Me,tBu. Angewandte Chemie, 104 (3). 327-329 doi:10.1002/ange.19921040322
Schäfer, Ansgar, Kollwitz, Markus, Ahlrichs, Reinhart (1996) Electronic excitation energies in copper selenide clusters. The Journal of Chemical Physics, 104 (18). 7113-7121 doi:10.1063/1.471404
McLean, A. D., Chandler, G. S. (1980) Contracted Gaussian basis sets for molecular calculations. I. Second row atoms, Z=11–18. The Journal of Chemical Physics, 72 (10) 5639-5648 doi:10.1063/1.438980
Ahlrichs, Reinhart, Taylor, Peter R. (1981) The choice of Gaussian basis sets for molecular electronic structure calculations. Journal de Chimie Physique, 78. 315-324 doi:10.1051/jcp/1981780315
Rappoport, Dmitrij (2021) Property-optimized Gaussian basis sets for lanthanides. The Journal of Chemical Physics, 155 (12) 124102pp. doi:10.1063/5.0065611
Ochsenfeld, Christian, Ahlrichs, Reinhart (1992) Anabinitioinvestigation of clusters NanCln. The Journal of Chemical Physics, 97 (5). 3487-3497 doi:10.1063/1.462983
Weigend, Florian, Häser, Marco, Patzelt, Holger, Ahlrichs, Reinhart (1998) RI-MP2: optimized auxiliary basis sets and demonstration of efficiency. Chemical Physics Letters, 294. 143-152 doi:10.1016/s0009-2614(98)00862-8
Rappoport, Dmitrij, Furche, Filipp (2010) Property-optimized Gaussian basis sets for molecular response calculations. The Journal of Chemical Physics, 133 (13). 134105pp. doi:10.1063/1.3484283
 
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