South Korean-based researchers have used first-principles quantum mechanical simulations to better understand the structure-property relationships in various polymorphic phases of iridium oxides to ...

Anodic oxides, produced through the controlled electrochemical oxidation of metals, are of significant interest due to their versatile electronic properties. These thin films exhibit a range of ...

Machine learning (ML) enables the accurate and efficient computation of fundamental electronic properties of binary and ternary oxide surfaces, as shown by scientists. Their ML-based model could be ...

The design and development of novel materials with superior properties demands a comprehensive analysis of their atomic and electronic structures. Electron energy parameters such as ionization ...