Overcoming computational uncertainties to reveal chemical sensitivity in single molecule conduction calculations

Journal of Chemical Physics

Volumn 122, Issue 22, 2005, Pages

  Solomon, Gemma C ^a   Reimers, Jeffrey R ^a   Hush, Noel S ^b  

^a UNIVERSITY OF SYDNEY   (Australia)

^b UNIVERSITY OF SYDNEY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL SENSITIVITY; COMPUTATIONAL UNCERTAINTIES; MOLECULAR ELECTRONICS; SEMI-FINITE ELECTRODES;

APPROXIMATION THEORY; CHEMISORPTION; ELECTRODES; ELECTRONIC STRUCTURE; GEOMETRY; MATHEMATICAL MODELS; PROBLEM SOLVING;

CHEMICAL SENSORS;

EID: 20544465081     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1926280     Document Type: Article

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