A quantum mechanical approach to TiO2 photocatalysis

Journal of Advanced Oxidation Technologies

Volumn 12, Issue 1, 2009, Pages 37-46

  Kiliç, Murat ^a   Çinar, Zekiye ^a  

^a YILDIZ TECHNICAL UNIVERSITY   (Turkey)

Author keywords

DFT Calculations; Heterogeneous Photocatalysis; Hydroxyl Radicals; Reactivity Descriptors

Indexed keywords

DESIGN FOR TESTABILITY; ORGANIC POLLUTANTS; PHOTOCATALYSIS; PHOTOCATALYSTS; QUANTUM THEORY; SALICYLIC ACID; SURFACE REACTIONS; TITANIUM DIOXIDE;

DFT CALCULATION; HETEROGENEOUS PHOTOCATALYSIS; HYDROXYL RADICALS; PHOTO CATALYTIC DEGRADATION; QUANTUM MECHANICAL METHOD; QUANTUM-MECHANICAL CALCULATION; REACTIVITY DESCRIPTORS; SURFACE ACTIVE SPECIES;

MECHANISMS;

EID: 77954468051     PISSN: 12038407     EISSN: None     Source Type: Journal    
DOI: 10.1515/jaots-2009-0104     Document Type: Article

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