Steps towards a Dislocation Ontology for Crystalline Materials

Ahmad Zainul Ihsan, Danilo Dessì, Mehwish Alam, Harald Sack, Stefan Sandfeld

Keywords: Dislocation Ontology, Ontology Design

TL;DR: In this work, the first steps towards formalizing the knowledge of dislocations -- a line-like defect in crystalline materials -- together with the relevant details concerning the crystallography are introduced.

Abstract: The field of Materials Science is concerned with, e.g., properties and performance of materials. An important class of materials are crystalline materials that usually contain "dislocation" -- a line-like defect type. Dislocation decisively determine many important materials properties. Over the past decades, significant effort was put into understanding dislocation behavior across different length scales both with experimental characterization techniques as well as with simulations. However, for describing such dislocation structures there is still a lack of a common standard to represent and to connect dislocation domain knowledge across different but related communities. An ontology offers a common foundation to enable knowledge representation and data interoperability, which are important components to establish a "digital twin". This paper outlines the first steps towards the design of an ontology in the dislocation domain and shows a connection with the already existing ontologies in the materials science and engineering domain.