Effects of morphology on surface hydroxyl concentration: A DFT comparison of anatase-TiO2 and γ-alumina catalytic supports

Journal of Catalysis

Volumn 222, Issue 1, 2004, Pages 152-166

  Arrouvel, C ^a   Digne, M ^a,b   Breysse, M ^c   Toulhoat, H ^a   Raybaud, P ^a  

^a IFP ENERGIES NOUVELLES   (France)

^b UNIVERSITÉ DE LYON   (France)

^c UNIVERSITÉ PIERRE ET MARIE CURIE   (France)

Author keywords

Anatase TiO2; Br nsted acidity; Density functional theory (DFT); Hydrotreatment; Hydroxyl groups; Infrared (IR); Morphology; Nanoparticles; Surface property; Alumina

Indexed keywords

ALUMINUM OXIDE; HYDROXYL GROUP; TITANIUM DIOXIDE;

ANALYSIS; ARTICLE; CATALYSIS; CATALYST; DENSITY FUNCTIONAL THEORY; HYDROXYLATION; INFRARED RADIATION; PRESSURE; SIMULATION; TEMPERATURE; THERMODYNAMICS;

EID: 0842348127     PISSN: 00219517     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jcat.2003.10.016     Document Type: Article

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