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1) Electron Population Analysis on LCAO-MO Molecular Wave Functions. I,
    Mulliken R.S. J. Chem. Phys., 1955, 23,1833
2) Electron Population Analysis on LCAO-MO Molecular Wave Functions. II.
    Overlap Populations, Bond Orders, and Covalent Bond Energies, Mulliken
    R.S. J. Chem. Phys., 1955, 23,1841
3) Electron Population Analysis on LCAO-MO Molecular Wave Functions. III
    Effects of Hybridization on Overlap and Gross AO Populations, Mulliken
    R.S. J. Chem. Phys., 1955, 23,2338
4) Electron Population Analysis on LCAO-MO Molecular Wave Functions. IV.
    Bondong and Antibonding in LCAO and Valence-Bond Theories, Mulliken R.S.
    J. Chem. Phys., 1955, 23,2343
5) Atomic Orbital Populations and Atomic Charges from Self-consisten Field
    Molecular Orbital Wavefunctions, Edgecombe K.E., Boyd R.J., J. Chem.
    Soc., Faraday Trans. 2, 1987, 83, 1307-1315
6) Classical chemical concepts from ab initio SCF calculations, Baker Jon,
    Theor. Chim. Acta, 1985, 68, 221-229
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zhangguangping(½ð±Ò+1): 2010-04-19 05:52
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