Effects of symmetry and atomic heterogeneity on X-ray intensities – a case of hypercentric distribution*
Abstract
A series expansion distribution function of the structure amplitude |F| has been used to calculate the generalised cumulative distribution function Nn(z) for a hypercentric crystal with n centres of symmetry. Modified expressions for moments have been derived considering the effect of hypercentrosymmetry for three different space groups P[unk], P2/m and Pmmm, which also take into account the effect of atomic heterogeneity in the crystal. The resultant change from the corresponding Wilson-type distribution is illustrated with the help of a hypothetical example and the effects of expansion terms have been discussed.
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Articles in the same Issue
- Crystal chemistry of compounds M3O[TO4]
- The crystal structure of C.I. Pigment Yellow 3, α-(1-hydroxyethylidene)-2-chloro-acetanilide-α-azo-(4′-chloro-2′-nitrobenzene)
- Solid-state reactions in “salt X”
- Grandite garnet structures in connection with the growth mechanism
- The crystal structure and electron density of tetraphenyl-silicon, (C6H5)4Si
- Effects of symmetry and atomic heterogeneity on X-ray intensities – a case of hypercentric distribution*
- Refinement of a partially disordered natrolite, Na2Al2Si3O10 · 2H2O
- The crystal structures of 1-(3′,5′-dinitrobenzoyloxy)-bicyclo[3.3.1]-9-oxanonane and 5-(3′,5′-dinitrobenzoyloxy)-cyclooctanone1
- The crystal structure of methoxymethoxy-2,4-dinitrobenzene1
- The crystal structure of 2-(3′,5′-dinitrobenzoyloxy)-tetrahydropyran Cyclohexane Solvate1
- The crystal structure of 2-(N-phthalimidomethoxy)-tetrahydropyran1
- The crystal structure of 9-oxabicyclo[3.3.1]non-1-yl diphenyl phosphate1
- The crystal structure of 9-oxabicyclo[3.3.1]non-l-yl methanesulphonate1
- Crystal and molecular structure of bis-tetrasulphurtetranitride-tetrachlorotin
- The crystal structure of 1,2-dibenzylidenehydrazinium hexafluoroarsenate
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