Water exchange dynamics of manganese(II), cobalt(II), and nickel (II) ions in aqueous solution

Journal of Computational Chemistry

Volumn 27, Issue 16, 2006, Pages 1944-1949

  Loffler, Hannes H ^a,b   Mohammed, Ahmed M ^a,c   Inada, Yasuhiro ^a,d   Funahashi, Shigenobu ^a  

^a NAGOYA UNIVERSITY   (Japan)

^b UNIVERSITY OF TOKYO   (Japan)

^c ADDIS ABABA UNIVERSITY   (Ethiopia)

^d INSTITUTE OF MATERIALS STRUCTURE SCIENCE   (Japan)

Author keywords

Kinetics; Reaction rates; Transition metal ions; Umbrella sampling; Water exchange

Indexed keywords

CHEMICAL ACTIVATION; COBALT; COMPUTER SIMULATION; IONS; MOLECULAR DYNAMICS; NICKEL; REACTION KINETICS; SOLUTIONS; WATER;

METAL IONS; MOLECULAR DYNAMICS SIMULATIONS; REACTION RATES; WATER EXCHANGE;

MANGANESE;

COBALT; ION; MANGANESE; NICKEL; WATER;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; QUANTUM THEORY; SOLUTION AND SOLUBILITY;

COBALT; COMPUTER SIMULATION; IONS; MANGANESE; MODELS, CHEMICAL; NICKEL; QUANTUM THEORY; SOLUTIONS; WATER;

EID: 33751206211     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.20462     Document Type: Article

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