Artigo
Hydrostatic and [001] Uniaxial Pressure on Anatase TiO2 by Periodic B3LYP-D* Calculations
Hydrostatic and [001] Uniaxial Pressure on Anatase TiO2 by Periodic B3LYP-D* Calculations Abstract: The effect of high hydrostatic and [001] uniaxial pressures on TiO2 anatase was studied under the framework of periodic calculations with the inclusion […]