3 papers
cond-mat.mtrl-sci2026
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…
physics.comp-ph2025
MDcraft -- a modern molecular dynamics simulation package with machine learning potentials support
I. S. Galtsov, R. V. Muratov, G. V. Vyskvarko +3
Molecular dynamics is widely used to study various phenomena, such as diffusion, shock wave propagation, and plasma dynamics. A wide range of software packages supports the expandi…
physics.atm-clus2025
Extraordinary manifestation of near electrostatic field caused by macroscopic quantum shell effects in submicron hemispherical clusters
S. E. Kuratov, I. S. Galtsov, S. A. Dyachkov +1
The existence of macroscopic shell structure of submicron metal clusters is known for several decades. Since the most studies provide theoretical analysis for clusters of spherical…