A general relation between the intrinsic convergence properties of SCF Hartree-Fock calculations and the stability conditions of their solutions.
Autor: | Facelli, J. C., Contreras, R. H. |
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Zdroj: | Journal of Chemical Physics; Oct1983, Vol. 79 Issue 7, p3421-3423, 3p |
Databáze: | Complementary Index |
Externí odkaz: |