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General hybrid density functional theory

โœ Scribed by Garnet Kin-Lic Chan

Publisher
John Wiley and Sons
Year
1998
Tongue
English
Weight
137 KB
Volume
69
Category
Article
ISSN
0020-7608

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โœฆ Synopsis

We generalize hybrid density functional theory to finite temperatures.

We find that the internal potential generated by the orbital functionals leads to complications in the statistical mechanics of the reference system and the self-consistent procedure to obtain the density.

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