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• W2076324229 abstract "The lithium atom and the lithium hydride molecule are studied by a method in which a product of one electron functions, each of which is a highly variable molecular orbital, is chosen to represent a configuration. All parameters in the wave function are varied in an unrestricted manner so as to minimize the energy. Open shell techniques and configuration interaction are employed. In four configurations 89% of the dissociation energy of LiH is calculated. The energy and the electron distribution are discussed as a function of internuclear distance." @default.
• W2076324229 created "2016-06-24" @default.
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• W2076324229 date "1964-01-01" @default.
• W2076324229 modified "2023-09-23" @default.
• W2076324229 title "A quantum mechanical study of the LiH molecule in the ground state" @default.
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• W2076324229 doi "https://doi.org/10.1016/0031-8914(64)90205-8" @default.
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