Density Functional Tight-Binding for Self-Consistent Computation of the Transport Properties of Molecular Electronic Devices

Proceedings of SPIE - The International Society for Optical Engineering

Volumn 5219, Issue , 2003, Pages 25-32

  Pecchia, A ^a   Latessa, L ^a   Di Carlo, A ^a   Lugli, P ^a  

^a Universit di Roma Tor Vergata   (Italy)

Author keywords

Green's Functions; Molecular Electronics; Non equilibrium Transport

Indexed keywords

DENSITY FUNCTIONAL THEORY; DENSITY-FUNCTIONAL TIGHT-BINDING (DFTB) METHOD; MOLECULAR ELECTRONICS; NON-EQUILIBRIUM TRANSPORT;

BOUNDARY CONDITIONS; CMOS INTEGRATED CIRCUITS; COMPUTER SIMULATION; ELECTRON TRANSPORT PROPERTIES; GREEN'S FUNCTION; HAMILTONIANS; MATRIX ALGEBRA; POISSON EQUATION; PROBABILITY DENSITY FUNCTION;

NANOTUBES;

EID: 2342487341     PISSN: 0277786X     EISSN: None     Source Type: Conference Proceeding    
DOI: 10.1117/12.507121     Document Type: Conference Paper

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