1969•Journal of Structural ChemistryRequires access

Calculation of internal orbitals in multi-atom molecules using the LCAO molecular orbital approximation

Н. М. Клименко, M. E. Dyatkina

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Key concepts: Linear combination of atomic orbitals, Molecular orbital, Localized molecular orbitals, Slater-type orbital, Atomic orbital, Molecular orbital theory, Atom (system on chip), Atomic physics

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