Valence type vacant orbitals for configuration interaction calculations
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[1] Henry F. Schaefer,et al. Multiconfiguration self‐consistent‐field study of the importance of triply and quadruply excited electronic configurations in the water molecule , 1980 .
[2] B. Roos,et al. A complete active space SCF method (CASSCF) using a density matrix formulated super-CI approach , 1980 .
[3] Paul H. Krupenie,et al. The spectrum of molecular nitrogen , 1977 .
[4] S. Huzinaga,et al. Projection Operators in Hartree-Fock Theory , 1973 .
[5] E. Davidson,et al. Theoretical Calculation of the Potential Curves of the Be2 Molecule , 1967 .
[6] Clemens C. J. Roothaan,et al. New Developments in Molecular Orbital Theory , 1951 .