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Chemical Physics

Volumn 284, Issue 3, 2002, Pages 607-614

An iterative procedure to determine Lennard-Jones parameters for their use in quantum mechanics/molecular mechanics liquid state simulations

(4) Martin M E a Aguilar, M A a Chalmet, S b Ruiz Lopez M F b

a UNIVERSITY OF EXTREMADURA (Spain)

b NANCY UNIVERSITÉ (France)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; ELECTRICITY; ELECTROCHEMICAL ANALYSIS; LIQUID; MOLECULAR MECHANICS; QUANTUM MECHANICS; SIMULATION; THERMODYNAMICS;

EID: 0037110534 PISSN: 03010104 EISSN: None Source Type: Journal
DOI: 10.1016/S0301-0104(02)00785-1 Document Type: Article

Times cited : (20)

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