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Journal of Chemical Physics

Volumn 116, Issue 23, 2002, Pages 10277-10286

Binding to gold(0): Accurate computational methods with application to AuNH3

(3) Lambropoulos, Nicholas A a Reimers, Jeffrey R a Hush, Noel S a

a UNIVERSITY OF SYDNEY (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; BINDING ENERGY; CHARGE TRANSFER; CHEMICAL BONDS; ELECTRODES; ELECTRON TRANSITIONS; FERMI LEVEL; GOLD COMPOUNDS; NANOSTRUCTURED MATERIALS; POLARIZATION; POSITIVE IONS; PROBABILITY DENSITY FUNCTION; SURFACE CHEMISTRY;

MOLECULAR ELECTRONICS; RELATIVISTIC EFFECT CORE POTENTIALS (RECP);

MOLECULAR DYNAMICS;

EID: 0037162251 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1473197 Document Type: Article

Times cited : (50)

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