Cargando…

Improvements to the Sink Strength Theory Used in Multi-Scale Rate Equation Simulations of Defects in Solids

The application of mean-field rate theory equations have proven to be a versatile method in simulating defect dynamics and temporal changes in the microstructure of materials. The reliability and usefulness of the method, however, depends critically on the defect interaction parameters used. In this...

Descripción completa

Detalles Bibliográficos
Autores principales: Ahlgren, Tommy, Heinola, Kalle
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7321583/
https://www.ncbi.nlm.nih.gov/pubmed/32526860
http://dx.doi.org/10.3390/ma13112621
Descripción
Sumario:The application of mean-field rate theory equations have proven to be a versatile method in simulating defect dynamics and temporal changes in the microstructure of materials. The reliability and usefulness of the method, however, depends critically on the defect interaction parameters used. In this study, we show that the main interaction parameter, the sink strength, intrinsically depends on the detrapping, or the dissociation process itself. We present a theory on how to determine the appropriate sink strengths. The correct sink strength required for a detrapping defect, is considerably larger than the values commonly used, and thus should not be neglected.