First-principles data for solid-solution Nb–Zr, Ta–Zr, and V–Zr binary alloys with body-centered-cubic structures
We present three open-access datasets containing density functional theory (DFT) calculations for refractory solid-solution binary alloys niobium–zirconium (NbZr), tantalum–zirconium (TaZr), and vanadium–zirconium (VZr) in 128-atom body-centered-cubic (BCC) supercells. These datasets extend our previously published fir...
Massimiliano Lupo Pasini, German Samolyuk, Jong Youl Choi et al.
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