scholarly journals Finite-temperature coupled cluster: Efficient implementation and application to prototypical systems

2020 ◽  
Vol 152 (22) ◽  
pp. 224104 ◽  
Author(s):  
Alec F. White ◽  
Garnet Kin-Lic Chan
Keyword(s):  
Finite Temperature ◽  
Efficient Implementation ◽  
Coupled Cluster

scholarly journals Thermofield Theory for Finite-Temperature Coupled Cluster

2019 ◽  
Vol 15 (11) ◽  
pp. 6127-6136 ◽  
Author(s):  
Gaurav Harsha ◽  
Thomas M. Henderson ◽  
Gustavo E. Scuseria
Keyword(s):  
Finite Temperature ◽  
Coupled Cluster

Orbital-optimized linearized coupled-cluster doubles with density-fitting and Cholesky decomposition approximations: an efficient implementation

2016 ◽  
Vol 18 (16) ◽  
pp. 11362-11373 ◽  
Author(s):  
Uğur Bozkaya
Keyword(s):  
Cholesky Decomposition ◽  
Efficient Implementation ◽  
Coupled Cluster ◽  
Density Fitting

An efficient implementation of the orbital-optimized linearized coupled-cluster double method with the density-fitting (DF-OLCCD) and Cholesky decomposition (CD-OLCCD) approximations is presented.

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