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The surface reactivity and structural properties of anatase TiO2 (001), (100), (101) and (105) surface researched with DFT

Wang, JZ; Zhou, JP; Wang, Y; Miao, NX; Guo, ZQ; Lei, YX

Zhou, JP (reprint author), Shaanxi Normal Univ, Sch Phys & Informat Technol, Xian 710119, Shaanxi, Peoples R China.

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES INDIA SECTION A-PHYSICAL SCIENCES, 2019; 89 (1): 193

Abstract

The surface reactivity and structural properties of anatase TiO2 (001), (100), (101) and (105) surfaces have been investigated with DFT method. The fo......

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