Electronic couplings and on-site energies for hole transfer in DNA: Systematic quantum mechanical/molecular dynamic study

Journal of Chemical Physics

Volumn 128, Issue 11, 2008, Pages

  Voityuk, Alexander A ^a,b  

^a INSTITUCIÓ CATALANA DE RECERCA I ESTUDIS AVANÇATS ICREA   (Spain)

^b UNIVERSITY OF GIRONA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

HOLE MOBILITY; MATRIX ALGEBRA; MOLECULAR DYNAMICS; OLIGOMERS; PARAMETER ESTIMATION; QUANTUM THEORY;

ELECTRON HOLE TRANSFER; ELECTRONIC COUPLINGS; THERMAL FLUCTUATIONS;

DNA;

DNA; NUCLEOTIDE;

ARTICLE; BASE PAIRING; CHEMICAL STRUCTURE; CHEMISTRY; ELECTRON; QUANTUM THEORY; THERMODYNAMICS;

BASE PAIRING; DNA; ELECTRONS; MODELS, MOLECULAR; NUCLEOTIDES; QUANTUM THEORY; THERMODYNAMICS;

EID: 41049105676     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2841421     Document Type: Article

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