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Home » Institute » Departments & Research Groups » Atomistic Modelling and Simulation » Atomistic Simulation of Mechanical Behaviour » ASMB Publications

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  • S. Starikov, I. Gordeev, Y. Lysogorskiy et al. Optimized interatomic potential for study of structure and phase transitions in Si-Au and Si-Al systems. Computational Materials Science, 184, 109891, (2020)
  • M. A. Korneva, S. Starikov, A. P. Zhilyaev et al. Atomistic modeling of grain boundary migration in nickel. Advanced Engineering Materials, 22, 2000115, (2020)
  • S. Starikov, V. Tseplyaev. Two-scale simulation of plasticity in molybdenum: combination of atomistic simulation and dislocation dynamics with non-linear mobility function. Computational Materials Science, 179, 109585, (2020)
  • A. Y. Zhizhchenko, P. Tonkaev, D. Gets et al. Light-emitting nanophotonic designs enabled by ultrafast laser processing of halide perovskites. Small, 16, 2000410, (2020)
  • S. Starikov, M. Mrovec, R. Drautz. Study of grain boundary self-diffusion in iron with different atomistic models. Acta Materialia, 188, 560-569, (2020)
  • A. Stamminger, B. Ziebarth, M. Mrovec et al. Fast diffusion mechanism in Li4P2S6 via a concerted process of interstitial Li ions. RSC Advances, 10, 10715-10722, (2020)
  • D. Smirnova, S. Starikov, G. Díaz Leines et al. Atomistic description of self-diffusion in molybdenum: a comparative theoretical study of non-Arrhenius behavior. Physical Review Materials, 4, 013605, (2020)
  • S. E. Restrepo, D. Di Stefano, M. Mrovec et al. Density functional theory calculations of iron - vanadium carbide interfaces and the effect of hydrogen. International Journal of Hydrogen Energy, 45, 2382-2389, (2020)
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