Wide band gap semiconductors are essential for today's electronic devices and energy
applications because of their high optical transparency, controllable carrier concentration …

Transparent conducting materials (TCMs) are required in many applications from solar cells
to transparent electronics. Develo** high performance materials combining the …

In the recent past, optoelectronic semiconductors have attracted significant research
attention both experimentally and theoretically toward large‐scale applications in energy …

Despite the impressive photovoltaic performances of perovskite solar cells (PSCs) with a
power conversion efficiency (PCE) beyond 22%, intensive studies are still required to …

Structure characterization and classification is frequently based on local environment
information of all or selected atomic sites in the crystal structure. Therefore, reliable and …

In the past decade we have witnessed the appearance of large databases of calculated
material properties. These are most often obtained with the Perdew-Burke-Ernzerhof (PBE) …

Perovskite oxides have been extensively studied for their wide range of compositions and
structures, as well as their valuable properties for various applications. Expanding from …

The growth of materials databases has yielded significant quantities of data to mine for new
energy materials using high-throughput screening methodologies. One application of …

Abstract The Materials Project (MP) is a community resource for theory-based data, web-
based materials analysis tools, and software for performing and analyzing calculations. The …

The zinc blende (γ) phase of copper iodide holds the record hole conductivity for intrinsic
transparent p-type semiconductors. In this work, we employ a high-throughput approach to …