Vibrational properties of impurities in semiconductors

Modelling and Simulation in Materials Science and Engineering

Volumn 17, Issue 8, 2009, Pages

  Estreicher, S K ^a   Backlund, D ^a   Gibbons, T M ^a   Docaj A ^a  

^a TEXAS TECH UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; CLASSICAL MOLECULAR DYNAMICS; DYNAMICAL MATRIX; EIGENVALUES; EIGENVECTORS; FIRST-PRINCIPLES; HOST CRYSTALS; IMPURITIES IN SEMI CONDUCTORS; MATRIX; MD SIMULATION; NON EQUILIBRIUM; NUCLEAR MOTIONS; PHONON DENSITY OF STATE; PSEUDOPOTENTIALS; SUPER CELL; THERMAL EQUILIBRIUMS; VIBRATIONAL FREE ENERGY; VIBRATIONAL LIFETIME; VIBRATIONAL MODES; VIBRATIONAL PROPERTIES;

DENSITY FUNCTIONAL THEORY; EIGENVALUES AND EIGENFUNCTIONS; MOLECULAR DYNAMICS; THERMAL CONDUCTIVITY; TIME VARYING SYSTEMS; WAVE FUNCTIONS;

CRYSTAL IMPURITIES;

EID: 70949107962     PISSN: 09650393     EISSN: 1361651X     Source Type: Journal    
DOI: 10.1088/0965-0393/17/8/084006     Document Type: Article

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