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International Journal of Quantum Chemistry

Volumn 90, Issue 1, 2002, Pages 309-326

Local kinetic energy and local temperature in the density-functional theory of electronic structure

(3) Ayers, Paul W a Parr, Robert G a Nagy, Agnes b

a University of North Carolina at Chapel Hill (United States)

b UNIVERSITY OF DEBRECEN (Hungary)

Author keywords

Density functional theory; Electronic structure; Local temperature; Nighness

Indexed keywords

APPROXIMATION THEORY; BOUNDARY CONDITIONS; CURRENT DENSITY; ELECTRONIC STRUCTURE; ELECTRONS; ENTROPY; FREE ENERGY; GROUND STATE; KINETIC ENERGY; PROBABILITY DENSITY FUNCTION; PROBABILITY DISTRIBUTIONS; QUANTUM THEORY; THEOREM PROVING; THERMAL EFFECTS; WAVE EQUATIONS;

DENSITY-FUNCTIONAL THEORY; ELECTRON LOCALIZATION FUNCTIONS;

THERMODYNAMICS;

EID: 0037026921 PISSN: 00207608 EISSN: None Source Type: Journal
DOI: 10.1002/qua.989 Document Type: Article

Times cited : (155)

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