Coupled cluster theory for high spin, open shell reference wave functions

1993 ◽  
Vol 99 (7) ◽  
pp. 5219-5227 ◽  
Author(s):  
Peter J. Knowles ◽  
Claudia Hampel ◽  
Hans‐Joachim Werner
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Open Shell ◽  
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pp. 124105 ◽  
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Oliver Heun ◽  
Jürgen Gauss ◽  
Péter G. Szalay
Keyword(s):  
High Spin ◽  
Open Shell ◽  
Coupled Cluster ◽  
Coupled Cluster Theory ◽  
Cluster Theory

Spin adapted restricted Hartree–Fock reference coupled cluster theory for open shell systems

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Vol 100 (5) ◽  
pp. 3706-3716 ◽  
Author(s):  
Pavel Neogrády ◽  
Miroslav Urban ◽  
Ivan Hubac̆
Keyword(s):  
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Coupled Cluster ◽  
Coupled Cluster Theory ◽  
Cluster Theory ◽  
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scholarly journals Exact parameterization of fermionic wave functions via unitary coupled cluster theory

2019 ◽  
Vol 151 (24) ◽  
pp. 244112 ◽  
Author(s):  
Francesco A. Evangelista ◽  
Garnet Kin-Lic Chan ◽  
Gustavo E. Scuseria
Keyword(s):  
Wave Functions ◽  
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Coupled Cluster Theory ◽  
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Spin adapted restricted open shell coupled cluster theory. Linear version

1992 ◽  
Vol 97 (7) ◽  
pp. 5074-5080 ◽  
Author(s):  
Pavel Neogrády ◽  
Miroslav Urban ◽  
Ivan Hubač
Keyword(s):  
Open Shell ◽  
Coupled Cluster ◽  
Coupled Cluster Theory ◽  
Cluster Theory ◽  
Linear Version
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