Investigation of mo-, pt-, and rh-doped rutile tio2 based on first-principles calculations

HIGHLIGHTS

• who: Xuefeng Lu et al. from the State Key LaboratoryLanzhou University Lanzhou, PR China have published the article: Investigation of Mo-, Pt-, and Rh-doped rutile TiO2 based on first-principles calculations, in the Journal: (JOURNAL) of 16/07/2018
• what: This work has shown that the band gap of the pure anatase phase TiO2 is about 3.23 eV which results in a significant reduction in the absorption efficiency of solar energy, therefore requiring performance improvement. This work provides a theoretical basis and experimental directions for doping anatase TiO2 and rutile TiO2 compound. The . . .
  

   

  

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