This Review highlights basic and transition metal conducting and semiconducting oxides.
We discuss their material and electronic properties with an emphasis on the crystal …

The electronic structures of ZnO were calculated using density functional theory, in which the
electronic interactions are described within the GGA+ U (GGA= generalized gradient …

In the present review, new approaches for the stabilization of metastable phases of zinc
oxide and the growth of ZnO single crystals under high pressures and high temperatures are …

Abstract Na doped ZnO nanocrystals (NCs) were successfully produced by sol–gel process
and characterized by X-ray diffraction (XRD), transmission electron microscopy (TEM), high …

Structural and mechanical properties of ZnO in four different phases, namely, B4 (wurtzite),
B3 (zinc-blende), B2 (CsCl) and B1 (rocksalt) are determined using ab initio density …

Being a promising candidate in next-generation optoelectronic applications, the study of
new polymorphs of zinc oxide (ZnO) is receiving the great attention of researchers. In this …

We present the quasiparticle band structure of ZnO in its zincblende (ZB) and rocksalt (RS)
phases at the Γ point, calculated within the GW approximation. The effect of the p–d …

Self‐powered and flexible photodetectors exhibit great potential in the application of optical
communication, deep space exploration, and other related fields. Herein, a self‐powered …

We have calculated the optical structure of wurtzite ZnO doped with Silicon (Si). The
calculations are based on the density functional theory with the generalized gradient …

Selection of a proper exchange and correlation potential for efficient treatment of excited-
state properties such as the electronic band structure is required in density functional theory …