2 papers
cond-mat.mtrl-sci2026
Vibrational and Electronic Properties of Np2O5 from Experimental Spectroscopy and First Principles Calculations
Binod K Rai, Shuxiang Zhou, Benjamin R. Heiner +7
High-valence actinide oxides are critical to understanding the behavior of 5f-electrons, yet their structural and electronic properties remain poorly understood due to challenges i…
cond-mat.mtrl-sci2025
The stability and topological behaviors in lanthanide antiperovskite nitrides: a high-throughput study
Shuxiang Zhou, Kevin Vallejo, Krzysztof Gofryk
Antiperovskite (APV) nitrides exhibit a diverse range of electronic properties, including superconductivity, magnetic effects, and nontrivial topological behaviors. In this study,…