Preprint
Oct 2026
Mechanical properties of V-4Ti-4Cr alloy from molecular dynamics with a neural-network potential
Machine-learning interatomic potentials enable large-scale atomistic simulations of vanadium alloys relevant to fusion applications, but reliable training and validation remain challenging in multicomponent systems. Here, we develop a descriptor-based DeepMD-DPA1 potential for the V-Ti-Cr system using a two-stage workf...
G. S. Demyanov, D. Minakov, S. B. Saltykov et al.
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