Data · dataset · 2019
AADIS: An atomistic analyzer for dislocations character and distribution
Listed in Teesside University Research Data Repository
In atomistic simulations of crystal plasticity, the characterization and representation of the dislocation core structure play a significant role for the understanding of mechanical behavior for crystalline materials.
Description
For this purpose, we present an accurate and convenient command-line tool: Atomistic Analyzer for DISlocations character and distribution (AADIS) for the post-analysis of the defective structures observed in various atomistic simulations.
The program has implemented the displacement vector analysis (DVA), the atomic strain tensor analysis (STA), the differential displacement analysis (DDA), the slip vector analysis (SVA), the interplanar disregistry analysis (IDA) and the Nye tensor analysis (NTA). Among these functionalities, a specific implementation of the program includes the extension of the NTA method and the characterization of misfit dislocations at bicrystal interfaces by various methods.
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The automatic feature provides a high throughput solution to the specific atomistic analysis on a batch of atomic configurations. Furthermore, several critical remarks on the advantages and shortcomings of each analysis method are revealed and discussed comprehensively, which provides guidance for their applications in atomistic simulations.
Links
Where it is published
- DOI doi.org/10.17632/hgc34yd3m3.1 ↗
DOI / persistent id · from researchdata tees ac uk
Catalogue records · 1
- OAI-PMH record data.mendeley.com/oai?verb=GetRecord&metadataPrefix=oai_dc&identifier=oai%3Adata… ↗
metadata API · from researchdata tees ac uk
Topics
- From keywords
- Earth & Environmental Science · Physics
Provenance · 1 source records, 7 field assertions
| Source | Key | Last seen | Raw |
|---|---|---|---|
| Teesside University Research Data Repository | oai:data.mendeley.com/hgc34yd3m3.1 | 17 h ago | JSON v1 |
| Field | Assertion | Extractor | Evidence |
|---|---|---|---|
| access_level | source · researchdata tees ac uk | connector:researchdata_tees_ac_uk@1.0.0 | |
| concepts[field].local:field:earth-environmental | mapping · researchdata tees ac uk | connector:researchdata_tees_ac_uk@1.0.0 | |
| concepts[field].local:field:physics | mapping · researchdata tees ac uk | connector:researchdata_tees_ac_uk@1.0.0 | |
| description | source · researchdata tees ac uk | connector:researchdata_tees_ac_uk@1.0.0 | /metadata/dc/description |
| license | source · researchdata tees ac uk | connector:researchdata_tees_ac_uk@1.0.0 | /metadata/dc/rights |
| publication_date | source · researchdata tees ac uk | connector:researchdata_tees_ac_uk@1.0.0 | |
| title | source · researchdata tees ac uk | connector:researchdata_tees_ac_uk@1.0.0 | /metadata/dc/title |