Probing the structure of salt water under confinement with first-principles molecular dynamics and theoretical X-ray absorption spectroscopy

Journal of Physical Chemistry Letters

Volumn 3, Issue 18, 2012, Pages 2653-2658

  Kulik, Heather J ^a   Schwegler, Eric ^b   Galli, Giulia ^c  

^a STANFORD UNIVERSITY   (United States)

^b LAWRENCE LIVERMORE NATIONAL LABORATORY   (United States)

^c UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

Chemical and Dynamical Processes in Solution; Liquids

Indexed keywords

BULK WATER; BULK-LIKE; DYNAMICAL PROCESS; INTERFACIAL LAYER; PURE WATER; SOLVATION SHELL; STRUCTURE OF LIQUIDS; WATER MOLECULE;

CHLORINE; HYDROGEN BONDS; LIQUIDS; MOLECULAR DYNAMICS; MOLECULES; SOLVATION; X RAY ABSORPTION SPECTROSCOPY;

PHASE INTERFACES;

EID: 84866620550     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz300932p     Document Type: Article

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