Calibrating quantum chemistry: A multi-teraflop, parallel-vector, full-configuration interaction program for the Cray-X1

2005 ◽  
Author(s):  
Zhengting Gan ◽  
R.J. Harrison
Keyword(s):  
Quantum Chemistry ◽  
Configuration Interaction ◽  
Full Configuration Interaction

Erratum: Pseudospectral full configuration interaction [J. Chem. Phys. 97, 1876 (1992)]

1993 ◽  
Vol 99 (5) ◽  
pp. 4238-4238 ◽  
Author(s):  
Todd J. Martinez ◽  
Aseem Mehta ◽  
Emily A. Carter
Keyword(s):  
Configuration Interaction ◽  
Chem Phys ◽  
Full Configuration Interaction

Full configuration interaction for the benzyl radical

1970 ◽  
Vol 4 (1) ◽  
pp. 73-87 ◽  
Author(s):  
V. A. Kuprievich ◽  
Yuri A. Kruglyak ◽  
E. V. Mozdor
Keyword(s):  
Configuration Interaction ◽  
Full Configuration Interaction ◽  
Benzyl Radical
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