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Perturbative treatment of triple excitations in coupled‐cluster calculations of nuclear magnetic shielding constants
Author(s):
Jürgen Gauss
,
John F. Stanton
Publication date
Created:
February 15 1996
Publication date
(Print):
February 15 1996
Journal:
The Journal of Chemical Physics
Publisher:
AIP Publishing
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EU NanoSafety Cluster Publications: Journal Articles
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Fully optimized contracted Gaussian basis sets for atoms Li to Kr
Ansgar Schäfer
,
Hans. Horn
,
Reinhart Ahlrichs
(1992)
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Efficient implementation of the gauge-independent atomic orbital method for NMR chemical shift calculations
Krzysztof Woliński
,
James F. Hinton
,
Peter Pulay
(1990)
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Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions
Per-Olof Widmark
,
Per-�ke Malmqvist
,
Bj�rn O. Roos
(1990)
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Author and article information
Journal
Title:
The Journal of Chemical Physics
Abbreviated Title:
The Journal of Chemical Physics
Publisher:
AIP Publishing
ISSN (Print):
0021-9606
ISSN (Electronic):
1089-7690
Publication date Created:
February 15 1996
Publication date (Print):
February 15 1996
Volume
: 104
Issue
: 7
Pages
: 2574-2583
Article
DOI:
10.1063/1.471005
SO-VID:
9fbb7d35-37c9-4085-b2c8-98628761da3d
Copyright ©
© 1996
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