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- W2368310897 abstract "Density functional theory is developed to calculate quantitatively the chemical bond. The theory is a new ab initio method other than matrix mechanics and wave mechanics. The Coulomb.inter- action is treated by multipolar expansion, so the theory is applicable to molecules, crystals and amorphous solids with short ordered range. The theory is especially suitable for the calculation of polarization and ferroelectricity of dielectrics." @default.
- W2368310897 created "2016-06-24" @default.
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- W2368310897 title "Density Functional Theory of Chemical Bond" @default.
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