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Modeling of helium bubble nucleation and growth in austenitic stainless steels using an Object Kinetic Monte Carlo method

A. de Backer G. Adjanor C. Domain 1 L.M. Lescoat S. Jublot-Leclerc 2 F. Fortuna 2 A. Gentils 2 J.C. Ortiz A. Souidi S.C. Becquart
1 Matériaux et Mécanique des Composants
2 CSNSM PS2
CSNSM - Centre de Spectrométrie Nucléaire et de Spectrométrie de Masse, CSNSM - Centre de Sciences Nucléaires et de Sciences de la Matière
Abstract : Implantation of 10 keV helium in 316L steel thin foils was performed in JANNuS-Orsay facility and modeled using a multiscale approach. Density Functional Theory (DFT) atomistic calculations [1] were used to obtain the properties of He and He-vacancy clusters, and the Binary Collision Approximation based code MARLOWE was applied to determine the damage and He-ion depth profiles as in [2,3]. The processes involved in the homogeneous He bubble nucleation and growth were defined and implemented in the Object Kinetic Monte Carlo code LAKIMOCA [4]. In particular as the He to dpa ratio was high, self-trapping of He clusters and the trap mutation of He-vacancy clusters had to be taken into account. With this multiscale approach, the formation of bubbles was modeled up to nanometer-scale size, where bubbles can be observed by Transmission Electron Microscopy. Their densities and sizes were studied as functions of fluence (up to 5 x 10(19) He/m(2)) at two temperatures (473 and 723 K) and for different sample thicknesses (25-250 nm). It appears that the damage is not only due to the collision cascades but is also strongly controlled by the He accumulation in pressurized bubbles. Comparison with experimental data is discussed and sensible agreement is achieved. Crown Copyright (C) 2014 Published by Elsevier B.V. All rights reserved.
Keywords : Austenitic stainless steel Trap mutation Self-trapping IMPLANTATION ACCUMULATION FE METALS SIMULATION TUNGSTEN CLUSTER DYNAMICS ALLOYS DEFECTS Damage Helium EVOLUTION
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Conference papers
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http://hal.in2p3.fr/in2p3-01165410
Contributor : Emilie Bonnardel <>
Submitted on : Friday, June 19, 2015 - 12:33:28 PM
Last modification on : Saturday, October 3, 2020 - 3:54:49 AM

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A. de Backer, G. Adjanor, C. Domain, L.M. Lescoat, S. Jublot-Leclerc, et al.. Modeling of helium bubble nucleation and growth in austenitic stainless steels using an Object Kinetic Monte Carlo method. 12th International Conference on Computer Simulation of Radiation Effects in Solids, Jun 2014, Alacant, Spain. pp.107-114, ⟨10.1016/j.nimb.2014.11.110⟩. ⟨in2p3-01165410⟩

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