Mechanistic insight into the water photooxidation on pure and sulfur-doped g-C3N4 photocatalysts from DFT calculations with dispersion corrections

Published 2015 View Full Article

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Title
Mechanistic insight into the water photooxidation on pure and sulfur-doped g-C3N4 photocatalysts from DFT calculations with dispersion corrections
Authors
Keywords
Water photooxidation, Photocatalysis, Graphitic carbon nitride, Reaction mechanism, DFT-D, Sulfur doping
Journal
JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL
Volume 406, Issue -, Pages 137-144
Publisher
Elsevier BV
Online
2015-05-30
DOI
10.1016/j.molcata.2015.05.018

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