scholarly journals An efficient algorithm for Cholesky decomposition of electron repulsion integrals

2019 ◽  
Vol 150 (19) ◽  
pp. 194112 ◽  
Author(s):  
Sarai D. Folkestad ◽  
Eirik F. Kjønstad ◽  
Henrik Koch
Keyword(s):  
Efficient Algorithm ◽  
Cholesky Decomposition ◽  
Electron Repulsion ◽  
Electron Repulsion Integrals

A highly efficient algorithm for electron repulsion integrals over relativistic four-component Gaussian-type spinors

2002 ◽  
Vol 116 (23) ◽  
pp. 10122-10128 ◽  
Author(s):  
Takeshi Yanai ◽  
Takahito Nakajima ◽  
Yasuyuki Ishikawa ◽  
Kimihiko Hirao
Keyword(s):  
Efficient Algorithm ◽  
Gaussian Type ◽  
Electron Repulsion ◽  
Highly Efficient ◽  
Electron Repulsion Integrals
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