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Journal of Computational Chemistry

Volumn 35, Issue 8, 2014, Pages 634-643

New accurate benchmark energies for large water clusters: DFT is better than expected

(2) Anacker, Tony a Friedrich, Joachim a

a CHEMNITZ UNIVERSITY OF TECHNOLOGY (Germany)

Author keywords

coupled cluster; explicitly correlated; interaction energy; water cluster

Indexed keywords

WATER;

ARTICLE; CHEMISTRY; COUPLED-CLUSTER; EXPLICITLY CORRELATED; INTERACTION ENERGY; QUANTUM THEORY; THERMODYNAMICS; WATER CLUSTER;

COUPLED-CLUSTER; EXPLICITLY CORRELATED; INTERACTION ENERGY; WATER CLUSTER;

QUANTUM THEORY; THERMODYNAMICS; WATER;

EID: 84894247316 PISSN: 01928651 EISSN: 1096987X Source Type: Journal
DOI: 10.1002/jcc.23539 Document Type: Article

Times cited : (58)

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