Atomistic simulation of defects formation and structure transitions in U-Mo alloys at swift heavy ion irradiation

International Conference for Young Scientists, Specialists, and Postgraduates on Nuclear Reactor Physics 2016

Kolotova, L.N.^1,2 ; Starikov, S.V.^1

Joint Institute for High Temperatures, Russian Academy of Sciences, Bldg 2, Izhorskaya 13, Moscow, Russia^1

Moscow Institute of Physics and Technology, InstitutskiyPereulok 9, Dolgoprudny, Moscow Region, Russia^2

关键词: Atomistic modeling;    Atomistic simulations;    Electron pressures;    Electron subsystem;    Electron thermal conductivity;    Structure transitions;    Swift heavy ion irradiation;    Two Temperature Model;   

Others  :  https://iopscience.iop.org/article/10.1088/1742-6596/781/1/012008/pdf
DOI  :  10.1088/1742-6596/781/1/012008

来源: IOP

【 摘 要 】

At irradiation of swift heavy ions, the track formation frequently takes place in nuclear materials. There is a large interest to understanding of the mechanisms of defects/track formation at this phenomenon. In this work, the atomistic simulation of defects formation and melting in U-Mo alloys at irradiation of swift heavy ions has been carried out. We use the two-temperature atomistic model with explicit account of electron pressure and electron thermal conductivity. This two-temperature model describes ionic subsystem by means of molecular dynamics while the electron subsystem is considered in the continuum approach. The various mechanisms of structure changes at irradiation are examined. In particular, the simulation results indicate that the defects formation may be produced without melting and subsequent crystallization. Threshold stopping power of swift ions for the defects formation at irradiation in the various conditions are calculated.