Ab Initio Study of the H2-H2S/MoS2 Gas-Solid Interface: The Nature of the Catalytically Active Sites

Journal of Catalysis

Volumn 189, Issue 1, 2000, Pages 129-146

  Raybaud, P ^a   Hafner, J ^b   Kresse, G ^b   Kasztelan, S ^a   Toulhoat, H ^a  

^a IFP ENERGIES NOUVELLES   (France)

^b UNIVERSITY OF VIENNA   (Austria)

Author keywords

Density functional calculations; Hydrodesulfurization catalysts; Molybdenum disulfide; Surface chemical composition; Surface structure

Indexed keywords

EID: 0034111098     PISSN: 00219517     EISSN: None     Source Type: Journal    
DOI: 10.1006/jcat.1999.2698     Document Type: Article

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