Sink strength calculations of dislocations and loops using OKMC
- 1. Department of Physics, P.O. Box 43 (Pehr Kalms gata 2), FI-00014 University of Helsinki (Finland)
- 2. Institute of Nuclear Materials Science, SCK-CEN, Boeretang 200, 2400 Mol (Belgium)
- 3. Unité Matériaux Et Transformations (UMET), UMR CNRS 8207, Université de Lille 1, ENSCL, F-59655 Villeneuve d'Ascq Cedex (France)
- 4. Laboratoire commun EDF-CNRS Etude et Modélisation des Microstructures pour le Vieillissement des Matériaux (EM2VM) (France)
- 5. EDF-R and D, Département Matériaux et Mécanique des Composants (MMC), Les Renardiéres, F-77818 Moret sur Loing Cedex (France)
Description
Highlights: •The sink strength for dislocations and loops are calculated using OKMC. •The master curves for the 1D to 3D defect migration transition are well reproduced. •We find that OKMC and theory are in good agreement for low volume fractions. -- Abstract: We calculate the sink strength of dislocations and toroidal absorbers using Object Kinetic Monte Carlo and compare with the theoretical expressions. We get good agreement for dislocations and loop-shaped absorbers of 3D migrating defects, provided that the volume fraction is low, and fair agreements for dislocations with 1D migrating defects. The master curve for the 3D to 1D transition is well reproduced with loop-shaped absorbers and fairly well with dislocations. We conclude that, on the one hand, the master curve is correct for a wide range of sinks and that, on the other, OKMC techniques inherently take correctly into account the strengths of sinks of any shape, provided that an effective way of appropriately inserting the sinks to be studied can be found
Availability note (English)
Available from http://dx.doi.org/10.1016/j.jnucmat.2013.08.052Additional details
Identifiers
- DOI
- 10.1016/j.jnucmat.2013.08.052;
- arXiv
- arXiv:1407.7218v1;
- PII
- S0022-3115(13)01070-2;
Publishing Information
- Journal Title
- Journal of Nuclear Materials
- Journal Volume
- 442
- Journal Issue
- 1-3
- Journal Page Range
- p. 218-226
- ISSN
- 0022-3115
- CODEN
- JNUMAM
INIS
- Country of Publication
- Netherlands
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 45090196
- Subject category
- S36: MATERIALS SCIENCE;
- Descriptors DEI
- COMPARATIVE EVALUATIONS; DEFECTS; DIAGRAMS; DISLOCATIONS; MONTE CARLO METHOD
- Descriptors DEC
- CALCULATION METHODS; CRYSTAL DEFECTS; CRYSTAL STRUCTURE; EVALUATION; INFORMATION; LINE DEFECTS
Optional Information
- Copyright
- Copyright (c) 2013 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.