Corrections to the density-functional theory electronic spectrum: Copper phthalocyanine

Applied Physics A: Materials Science and Processing

Volumn 95, Issue 1, 2009, Pages 257-263

  Vazquez H ^a   Jelinek P ^b   Brandbyge, M ^a   Jauho, A P ^a,c   Flores, F ^d  

^a TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

^b INSTITUTE OF PHYSICS   (Czech Republic)

^c AALTO UNIVERSITY   (Finland)

^d UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; MOLECULAR ORBITALS; PROBABILITY DENSITY FUNCTION; STANDARDS; TIME VARYING SYSTEMS; WAVE FUNCTIONS;

COPPER PHTHALOCYANINES; DENSITY-FUNCTIONAL THEORIES; DFT METHODS; EIGEN VALUES; ELECTRONIC SPECTRUM; ENERGY LEVELS; EXCHANGE AND CORRELATIONS; FUNCTIONALS; MANY BODIES; MOLECULAR LEVELS; SELF INTERACTIONS; SEMI-EMPIRICAL;

DENSITY FUNCTIONAL THEORY;

EID: 60749096787     PISSN: 09478396     EISSN: 14320630     Source Type: Journal    
DOI: 10.1007/s00339-008-5022-0     Document Type: Article

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