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First-order correction to the three-body correlation function

✍ Scribed by Ivo Nezbeda; Gerhard Kahl


Book ID
107735283
Publisher
Elsevier Science
Year
1991
Tongue
English
Weight
257 KB
Volume
183
Category
Article
ISSN
0009-2614

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First-order correlation orbitals for the
✍ Andrzej LeΕ›; Ludwik Adamowicz πŸ“‚ Article πŸ“… 1991 πŸ› Elsevier Science 🌐 English βš– 581 KB

The originally proposed first-order correlation orbital method (L. Adamowicz and R.J. Bartlett, J. Chem. Phys. 86 ( 1987) 63 14) has been extended in order to include the MCSCF zeroth-order wave function. The present method is based on the perturbation theory with the zeroth-order Hamiltonian sugges