Energetics and vibrational frequencies of interstitial H2 molecules in semiconductors

Physical Review Letters

Volumn 80, Issue 10, 1998, Pages 2177-2180

  De Walle, Van ^a   Chris, G ^a  

^a PALO ALTO RESEARCH CENTER   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; CALCULATIONS; CHEMICAL BONDS; ELECTRIC CHARGE; ELECTRONIC PROPERTIES; HYDROGEN; LATTICE CONSTANTS; MOLECULAR VIBRATIONS; MOLECULES; PROBABILITY DENSITY FUNCTION;

CHARGE DENSITY; DENSITY FUNCTIONAL THEORY; ENERGETICS; INTERSTITIAL MOLECULE; LOCAL DENSITY APPROXIMATION; VIBRATIONAL FREQUENCY;

SEMICONDUCTOR MATERIALS;

EID: 0032498769     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.80.2177     Document Type: Article

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