Analytic energy second derivatives for general correlated...

Analytic energy second derivatives for general correlated wavefunctions, including a solution of the first-order coupled-perturbed configuration-interaction equations

Douglas J. Fox, Yoshihiro Osamura, Mark R. Hoffmann, Jeffrey F. Gaw, George Fitzgerald, Yukio Yamaguchi, Henry F. Schaefer III
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Volume:
102
Year:
1983
Language:
english
Pages:
3
DOI:
10.1016/0009-2614(83)80648-4
File:
PDF, 282 KB
english, 1983
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