Insights into the effect of surface hydroxyls on CO 2 hydrogenation over Pd/γ-Al 2O 3 catalyst: A computational study

Applied Catalysis B: Environmental

Volumn 126, Issue , 2012, Pages 108-120

  Zhang, Riguang ^a   Liu, Hongyan ^a   Wang, Baojun ^a   Ling, Lixia ^a  

^a TAIYUAN UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

CO 2 hydrogenation; Density functional theory; Hydroxylation; Pd Al 2O 3; Support

Indexed keywords

CO FORMATION; COMPUTATIONAL STUDIES; ELEMENTARY STEPS; HIGH SELECTIVITY; METHANE FORMATION; PD PARTICLE; PD PARTICLE SIZE; SLAB MODEL; SURFACE HYDROXYL; TETRAMERS;

ALUMINUM; CATALYST SELECTIVITY; DENSITY FUNCTIONAL THEORY; HYDROGENATION; HYDROXYLATION; METHANATION; METHANE; METHANOL; OLIGOMERS; PRODUCT DESIGN; SUPPORTS;

CARBON DIOXIDE;

EID: 84864755278     PISSN: 09263373     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.apcatb.2012.07.009     Document Type: Article

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