23 citations · 24 across the 3 of their papers we have counts for
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Mechanical properties of V-4Ti-4Cr alloy from molecular dynamics with a neural-network potential
G. S. Demyanov, D. V. Minakov, S. B. Saltykov +2
Machine-learning interatomic potentials enable large-scale atomistic simulations of vanadium alloys relevant to fusion applications, but reliable training and validation remain cha…
Extraction of different electronic contributions to transport properties of transition metals from first principles
I. S. Galtsov, D. V. Minakov, P. R. Levashov
Accurate transport properties calculations in transition metals require treating inter-orbital hybridization, which is often poorly captured by simplified single-band models. We pr…
A wide-range temperature-dependent deep potential for sodium with near-experimental accuracy from melting to the critical point
G. S. Demyanov, D. V. Minakov, V. B. Fokin +1
We construct temperature-dependent deep potentials for sodium using finite-temperature DFT data obtained with the PBE, AM05, and SCAN exchange-correlation functionals and inve…