Theoretical Compton profile anisotropics in molecules and solids. VII. Zero point Compton profile anisotropies and bond polarities in alkali halide diatomic molecules

Robert L. Matcha; Bernard M. Pettitt

doi:10.1063/1.439700

Theoretical Compton profile anisotropics in molecules and solids. VII. Zero point Compton profile anisotropies and bond polarities in alkali halide diatomic molecules

Robert L. Matcha, Bernard M. Pettitt

Research output: Contribution to journal › Article › peer-review

3 Scopus citations

Abstract

A correlation between bond polarities and zero point Compton profile anisotropies is shown for alkali halide molecules. The correlation derives from the fact that both quantities are determined by molecular binding and antibinding forces and are thus functionally related to nuclear charge ratios.

Original language	English (US)
Pages (from-to)	4588-4590
Number of pages	3
Journal	The Journal of chemical physics
Volume	72
Issue number	8
DOIs	https://doi.org/10.1063/1.439700
State	Published - 1979
Externally published	Yes

ASJC Scopus subject areas

General Physics and Astronomy
Physical and Theoretical Chemistry

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title = "Theoretical Compton profile anisotropics in molecules and solids. VII. Zero point Compton profile anisotropies and bond polarities in alkali halide diatomic molecules",

abstract = "A correlation between bond polarities and zero point Compton profile anisotropies is shown for alkali halide molecules. The correlation derives from the fact that both quantities are determined by molecular binding and antibinding forces and are thus functionally related to nuclear charge ratios.",

author = "Matcha, {Robert L.} and Pettitt, {Bernard M.}",

year = "1979",

doi = "10.1063/1.439700",

language = "English (US)",

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journal = "The Journal of chemical physics",

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AU - Matcha, Robert L.

AU - Pettitt, Bernard M.

PY - 1979

Y1 - 1979

N2 - A correlation between bond polarities and zero point Compton profile anisotropies is shown for alkali halide molecules. The correlation derives from the fact that both quantities are determined by molecular binding and antibinding forces and are thus functionally related to nuclear charge ratios.

AB - A correlation between bond polarities and zero point Compton profile anisotropies is shown for alkali halide molecules. The correlation derives from the fact that both quantities are determined by molecular binding and antibinding forces and are thus functionally related to nuclear charge ratios.

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U2 - 10.1063/1.439700

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Theoretical Compton profile anisotropics in molecules and solids. VII. Zero point Compton profile anisotropies and bond polarities in alkali halide diatomic molecules

Abstract

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