A van der Waals density functional study of the adsorption of ethanol on the α-alumina (0001) surface

Surface Science

Volumn 621, Issue , 2014, Pages 16-22

  Johnston, Karen ^a  

^a UNIVERSITY OF STRATHCLYDE   (United Kingdom)

Author keywords

adsorption; density functional calculations

Indexed keywords

ADSORPTION ENERGIES; ADSORPTION OF ETHANOL; ADSORPTION STRUCTURES; DENSITY-FUNCTIONAL STUDY; FUNCTIONALS; GRADIENT APPROXIMATION; PARTIAL CHARGES; VAN DER WAALS;

ALUMINA; DENSITY FUNCTIONAL THEORY; ETHANOL; VAN DER WAALS FORCES;

ADSORPTION;

EID: 84891754991     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2013.09.030     Document Type: Article

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