✦ LIBER ✦

Density Functional Characterization of the Band Edges, the Band Gap States, and the Preferred Doping Sites of Halogen-Doped TiO2

✍ Scribed by Yang, Kesong; Dai, Ying; Huang, Baibiao; Whangbo, Myung-Hwan

Book ID: 115464397
Publisher: American Chemical Society
Year: 2008
Tongue: English
Weight: 220 KB
Volume: 20
Category: Article
ISSN: 0897-4756
DOI: 10.1021/cm801741m

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Direct observation of Al-doping-induced

Direct observation of Al-doping-induced electronic states in the valence band and band gap of ZnO films

✍ Gabás, Mercedes; Torelli, Piero; Barrett, Nicholas T.; Sacchi, Maurizio; Bruneva 📂 Article 📅 2011 🏛 The American Physical Society 🌐 English ⚖ 364 KB

The Band Structure and Electronic Densit

The Band Structure and Electronic Density of States of Thermoelectric Co-Doped Magnesium Silicide

✍ Fu, Chun Lin; Liao, Huan; Cai, Wei; Zhang, Chao Yang 📂 Article 📅 2011 🏛 Trans Tech Publications, Ltd. 🌐 English ⚖ 470 KB

Effect of V doping on the band-gap reduc

Effect of V doping on the band-gap reduction of porous TiO2 films prepared by sol–gel route

✍ Zhifeng Liu; Jing Ya; Lei E; Ying Xin; Wei Zhao 📂 Article 📅 2010 🏛 Elsevier Science 🌐 English ⚖ 866 KB

Density Functional Characterization of t

Density Functional Characterization of the Electronic Structure and Visible-Light Absorption of Cr-Doped Anatase TiO2

✍ Kesong Yang; Ying Dai; Baibiao Huang 📂 Article 📅 2009 🏛 John Wiley and Sons 🌐 English ⚖ 338 KB 👁 2 views

## Abstract __To evaluate the electronic and optical properties of Cr‐doped anatase TiO~2~, three possible Cr‐doped TiO~2~ models, including Cr at a Ti site (model I), Cr at a Ti site with an oxygen vacancy compensation (model II), and an interstitial Cr site (model III), are studied by means of fi

Is the Band Gap of Pristine TiO 2 Narrow

Is the Band Gap of Pristine TiO 2 Narrowed by Anion- and Cation-Doping of Titanium Dioxide in Second-Generation Photocatalysts?

✍ Serpone, Nick 📂 Article 📅 2006 🏛 American Chemical Society 🌐 English ⚖ 177 KB

New Insights into the Band-Gap Narrowing

New Insights into the Band-Gap Narrowing of (N, P)-Codoped TiO2 from Hybrid Density Functional Theory Calculations

✍ Run Long; Niall J. English 📂 Article 📅 2011 🏛 John Wiley and Sons 🌐 English ⚖ 931 KB