Local and nonlocal density functional calculations of the molecular structure of isomeric thiadiazole monoxides

International Journal of Quantum Chemistry

Volumn 81, Issue 1, 2001, Pages 105-115

  Glossman Mitnik, Daniel ^a   Márquez Lucero, Alfredo ^a  

^a CENTRO DE INVESTIGACIÓN EN MATERIALES AVANZADOS   (Mexico)

Author keywords

[No Author keywords available]

Indexed keywords

CARRIER CONCENTRATION; ENERGY GAP; ISOMERS; OLIGOMERS; OPTIMIZATION; PROBABILITY DENSITY FUNCTION; SEMICONDUCTING POLYMERS;

FUKUI FUNCTIONS; HARTREE-FOCK THEORIES; THIADIAZOLE MONOXIDES;

MOLECULAR STRUCTURE;

EID: 0001846507     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/1097-461X(2001)81:1<105::AID-QUA12>3.0.CO;2-7     Document Type: Article

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