Water on the MgO(001) surface: Surface reconstruction and ion solvation

Journal of Physical Chemistry Letters

Volumn 6, Issue 12, 2015, Pages 2310-2314

  Ončák, Milan ^a   Włodarczyk, Radosław ^a   Sauer, Joachim ^a  

^a HUMBOLDT UNIVERSITY   (Germany)

Author keywords

density functional theory; ion solvation; magnesium oxide dissolution; surface reconstruction; water adsorption

Indexed keywords

DENSITY FUNCTIONAL THEORY; HYDROXYLATION; IONS; MAGNESIA; QUANTUM THEORY; SOLVATION; STATISTICAL MECHANICS; THERMODYNAMICS;

AMBIENT CONDITIONS; HYDROXYLATED SURFACES; ION SOLVATION; OXIDE DISSOLUTION; RECONSTRUCTED SURFACES; STRUCTURE MODELING; SURFACE HYDROXYLATIONS; WATER ADSORPTION;

SURFACE RECONSTRUCTION;

EID: 84934905461     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/acs.jpclett.5b00885     Document Type: Article

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