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Journal of Chemical Physics

Volumn 128, Issue 14, 2008, Pages

Toward accurate thermochemical models for transition metals: G3Large basis sets for atoms Sc-Zn

(5) Mayhall, Nicholas J a Raghavachari, Krishnan a Redfern, Paul C b Curtiss, Larry A b Rassolov, Vitaly c

a INDIANA UNIVERSITY (United States)

b ARGONNE NATIONAL LABORATORY (United States)

c UNIVERSITY OF SOUTH CAROLINA (United States)

Author keywords

[No Author keywords available]

Indexed keywords

GAUSSIAN DISTRIBUTION; IONIZATION POTENTIAL; POLARIZATION;

DISSOCIATION ENERGIES; GAUSSIAN PRIMITIVES;

TRANSITION METALS;

EID: 42349113858 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.2896084 Document Type: Article

Times cited : (18)

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