Coordination numbers of alkali metal ions in aqueous solutions

Biophysical Chemistry

Volumn 124, Issue 3, 2006, Pages 192-199

  Varma, Sameer ^a   Rempe, Susan B ^a  

^a SANDIA NATIONAL LABORATORIES   (United States)

Author keywords

Ab initio; Alkali metal ions; Force fields; Hydration numbers; Molecular dynamics; Quasi chemical theory

Indexed keywords

ALKALI; LITHIUM ION; METAL ION; POTASSIUM ION; SODIUM ION;

AB INITIO CALCULATION; AQUEOUS SOLUTION; ARTICLE; DATA ANALYSIS; ENERGY TRANSFER; HYDRATION; MICROENVIRONMENT; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; PRIORITY JOURNAL; SIMULATION; THEORETICAL STUDY;

METALS, ALKALI; MODELS, MOLECULAR; SOLUTIONS; WATER;

EID: 33750822536     PISSN: 03014622     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bpc.2006.07.002     Document Type: Article

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