no code implementations • 29 Jan 2021 • Shuo Li, Junjie He, Petr Nachtigall, Lukas Grajciar, Federico Brivio
Our results indicate that both bulk phase and isolated $VS_4$ NWs are semiconductors with band gaps of 2. 24 and 2. 64 eV, respectively, and that they prefer the antiferromagnetic (AFM) ground state based on DFT calculations.
Materials Science Strongly Correlated Electrons Chemical Physics Computational Physics Quantum Physics A.0
