English

Stainless steel in an electronically excited state

Materials Science 2025-10-28 v3

Abstract

Understanding the non-equilibrium behavior of stainless steel under extreme electronic excitation remains a critical challenge for laser processing and radiation science. We employ a hybrid framework integrating density-functional tight binding, transport Monte Carlo, and Boltzmann equations to model austenitic stainless steel (Fe0.5875_{0.5875}Cr0.25_{0.25}Mn0.09_{0.09}Ni0.07_{0.07}C0.0025_{0.0025}) under ultrafast irradiation. The developed approach uniquely bridges atomic-scale electronic dynamics and mesoscale material responses, enabling the quantitative mapping of electron-temperature-dependent properties (electronic heat capacity, thermal conductivity, and electron-phonon coupling) up to the electronic temperatures Te~25,000 K. Two distinct lattice disordering mechanisms are identified: nonthermal melting at Te~10,000 K (the dose ~1.4 eV/atom), where the lattice collapses on sub-picosecond timescales without atomic heating driven by electronic excitation modifying the interatomic potential; and thermal melting (at ~0.45 eV/atom), induced by electron-phonon coupling on picosecond timescales. The derived parameters enable predictive modeling of stainless steel under extreme conditions, with implications for laser machining and radiation-resistant material design.

Keywords

Cite

@article{arxiv.2504.19798,
  title  = {Stainless steel in an electronically excited state},
  author = {Nikita Medvedev},
  journal= {arXiv preprint arXiv:2504.19798},
  year   = {2025}
}