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Formulas of the tight-binding interpolation method for crystals of perovskite type

✍ Scribed by V. G. Granovskii; Yu. G. Sindeev

Book ID
112426470
Publisher
Springer
Year
1973
Tongue
English
Weight
222 KB
Volume
16
Category
Article
ISSN
1573-9228

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## Abstract An __ab initio__ method for calculating the energies of excess‐electron bands in a molecular crystal is developed. These energies represent the electron affinities of a crystal. The present method employs a tight‐binding approximation to describe the molecules in a crystal and a set of