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Influence of Coulomb-attenuation on exchange?correlation functional quality

โœ Scribed by Peach, Michael J. G.; Cohen, Aron J.; Tozer, David J.


Book ID
121401222
Publisher
Royal Society of Chemistry
Year
2006
Tongue
English
Weight
752 KB
Volume
8
Category
Article
ISSN
1463-9076

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## Abstract The influence of different local statistical exchange and correlation approximations for the coreโ€core and conduction bandโ€core interactions on a calculation of binding energies and stable crystal structures within Harrison's first principles pseudopotential formalism is discussed. It i