Linear-scaling density functional theory simulations of polar semiconductor nanorods

Journal of Physics: Conference Series

Volumn 367, Issue 1, 2012, Pages

  Hine, Nicholas D M ^a   Avraam, Philip W ^a   Tangney, Paul ^a   Haynes, Peter D ^a  

^a IMPERIAL COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATION THEORY; COMPUTATIONAL METHODS; DIPOLE MOMENT; ELECTRIC FIELDS; FERMI LEVEL; NANORODS; SURFACE CHEMISTRY; ZINC SULFIDE;

BAND EDGE STATE; COMPUTATIONAL EFFORT; DENSITY FUNCTIONAL THEORY SIMULATIONS; ELECTRONIC SURFACE STATE; POLAR SEMICONDUCTORS; POTENTIAL DIFFERENCE; SPONTANEOUS POLARIZATIONS; WURTZITE STRUCTURE;

DENSITY FUNCTIONAL THEORY;

EID: 84862190656     PISSN: 17426588     EISSN: 17426596     Source Type: Conference Proceeding    
DOI: 10.1088/1742-6596/367/1/012002     Document Type: Conference Paper

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