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Transferable integrals in a deformation density approach to crystal orbital calculations. V. Coupling coefficients for crystal symmetry functions
Author(s) -
Avery John,
Ørmen PerJohan
Publication year - 2009
Publication title -
international journal of quantum chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.484
H-Index - 105
eISSN - 1097-461X
pISSN - 0020-7608
DOI - 10.1002/qua.560180863
Subject(s) - coupling (piping) , symmetry (geometry) , crystal (programming language) , deformation (meteorology) , physics , scattering , mathematical physics , molecular physics , chemistry , quantum mechanics , condensed matter physics , classical mechanics , mathematical analysis , materials science , mathematics , geometry , meteorology , computer science , metallurgy , programming language
Coupling coefficients for symmetrized sinusoidal functions in crystals are discussed. These coupling coefficients, which are analogous to Condon‐Shortley coefficients, can be used to calculate generalized scattering factors.