|
|||||
|
|
Density functional theory analysis of the structural and electronic properties of TiO2 rutile and anatase polytypes: performances of different exchange-correlation functionals |
|
| Authors: | Labat Frédéric Baranek Philippe Domain Christophe Minot Christian Adamo Carlo |
| Institution: | Laboratoire d'Electrochimie et Chimie Analytique, UMR-7575, ENSCP, 11 rue Pierre et Marie Curie, 75231 Paris Cedex 05, France. |
| Abstract: | |
| Keywords: | |
| 本文献已被 PubMed 等数据库收录！ | |