Article ID Journal Published Year Pages File Type
5418661 Journal of Molecular Structure: THEOCHEM 2006 4 Pages PDF
Abstract
Density functional methods were developed, in which the Coulomb electron-electron interaction is split into a long- and a short-range part. In such methods, one term is calculated using traditional density functional approximations, like the local density approximation. The present paper tries to shed some light upon the best way to do it by comparing the accuracy of the local density approximation with accurate results for the He atom.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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