Theoretical study of the gas X-ray diffraction of carbon dioxide

The effect of molecular electron correlation on the total (elastic plus inelastic) gas X-ray scattering intensities of CO 2 has been investigated theoretically. The study suggests that the correlation effect is substantially larger than indicated by a recent experimental investigation.

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Bibliographic Details
Published inChemical physics letters Vol. 113; no. 3; pp. 320 - 322
Main Authors Breitenstein, Martin, Meyer, Hermann, Schweig, Armin
Format Journal Article
LanguageEnglish
Published Amsterdam Elsevier B.V 01.01.1985
Elsevier Science
Subjects
Condensed matter: structure, mechanical and thermal properties
Exact sciences and technology
Physics
Structure of solids and liquids; crystallography
X-ray diffraction and scattering
Intensity
Carbon dioxide
Theoretical study
Hartree Fock theory
X ray scattering
Electron correlation
X ray diffraction
Inorganic compound
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Summary:The effect of molecular electron correlation on the total (elastic plus inelastic) gas X-ray scattering intensities of CO 2 has been investigated theoretically. The study suggests that the correlation effect is substantially larger than indicated by a recent experimental investigation.
ISSN:0009-2614
1873-4448
DOI:10.1016/0009-2614(85)80270-0