A density functional theory and experimental study of CO 2 interaction with brookite TiO 2

Journal of Physical Chemistry C

Volumn 116, Issue 37, 2012, Pages 19755-19764

  Rodriguez, Monique M ^a   Peng, Xihong ^b   Liu, Lianjun ^c   Li, Ying ^c   Andino, Jean M ^a  

^a Arizona State University   (United States)

^b ARIZONA STATE UNIVERSITY   (United States)

^c University of Wisconsin Milwaukee   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ANATASE TIO; BROOKITE TIO; COMPUTATIONAL RESULTS; DIFFUSE REFLECTANCE FOURIER TRANSFORM INFRARED SPECTROSCOPIES; EXPERIMENTAL STUDIES; FIRST PRINCIPLE CALCULATIONS; SLAB SYSTEMS; SPIN DENSITIES;

CHARGE TRANSFER; DENSITY FUNCTIONAL THEORY; FOURIER TRANSFORM INFRARED SPECTROSCOPY; MOLECULES; OXYGEN; TITANIUM DIOXIDE;

CARBON DIOXIDE;

EID: 84866690469     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp302342t     Document Type: Article

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