Electronic and optical properties of pure and Mo doped anatase TiO2 using GGA and GGA+U calculations
Author:
Publisher
Elsevier BV
Subject
Electrical and Electronic Engineering,Condensed Matter Physics,Electronic, Optical and Magnetic Materials
Reference22 articles.
1. First-principles calculations for geometrical structures and electronic properties of Si-doped TiO2
2. Optical properties of anatase and rutile titanium dioxide: Ab initio calculations for pure and anion-doped material
3. Electronic properties of F/Zr co-doped anatase TiO2 photocatalysts from GGA +U calculations
4. Photocatalytic activity of V5+, Mo6+ and Th4+ doped polycrystalline TiO2 for the degradation of chlorpyrifos under UV/solar light
5. Electronic Properties of Rutile TiO2 with Nonmetal Dopants from First Principles
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