TiO 2 anatase's bulk and (001) surface, structural and electronic properties: A DFT study on the importance of Hubbard and van der Waals contributions

出版年份 2016 全文链接

标题

作者

关键词

DFT+, U, vdW, Dispersion forces, TiO, 2, Anatase, (001) surface, CO, 2, adsorption

出版物

SURFACE SCIENCE

Volume 653, Issue -, Pages 187-196

出版商

Elsevier BV

发表日期

2016-07-10

DOI

10.1016/j.susc.2016.07.003

向作者/读者发起求助以获取更多资源

Protocol

在线求助

Reagent

在线求助

Reprint

联系作者

Find Funding. Review Successful Grants.

Explore over 25,000 new funding opportunities and over 6,000,000 successful grants.

Explore

Ask a Question. Answer a Question.

Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.

Get Started