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Electronic structure and photoabsorption of Ti 3+ ions in reduced anatase and rutile TiO 2

Journal Article · · Physical Chemistry Chemical Physics. PCCP (Print)
DOI:https://doi.org/10.1039/c8cp02648c· OSTI ID:1540011
 [1];  [2];  [1];  [1];  [2];  [2];  [2];  [3];  [2];  [4]
  1. Beijing Computational Science Research Center; Beijing; P. R. China
  2. State Key Laboratory of Molecular Reaction Dynamics; Dalian Institute of Chemical Physics; Chinese Academy of Science; Dalian; P. R. China
  3. Department of Chemistry, Princeton University; Princeton; USA
  4. School of Physics and Nuclear Energy Engineering; Beihang University; Beijing 100191; P. R. China; Beijing Computational Science Research Center
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We have used two-photon photoemission (2PPE) spectroscopy and first-principles density functional theory calculations to investigate the electronic structure and photoabsorption of the reduced anatase TiO2(101) and rutile TiO2(110) surfaces.

Research Organization:
Princeton Univ., NJ (United States)
Sponsoring Organization:
USDOE Office of Science (SC)
DOE Contract Number:
SC0007347
OSTI ID:
1540011
Journal Information:
Physical Chemistry Chemical Physics. PCCP (Print), Vol. 20, Issue 26; ISSN 1463-9076
Publisher:
Royal Society of Chemistry
Country of Publication:
United States
Language:
English

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