Shared Metadata for Data-Centric Materials Science

The expansive production of data in materials science, their widespread sharing and repurposing requires educated support and stewardship. In order to ensure that this need helps rather than hinders scientific work, the implementation of the FAIR-data principles (Findable, Accessible, Interoperable, and Reusable) must not be too narrow. Besides, the wider materials-science community ought to agree on the strategies to tackle the challenges that are specific to its data, both from computations and experiments. In this paper, we present the result of the discussions held at the workshop on "Shared Metadata and Data Formats for Big-Data Driven Materials Science". We start from an operative definition of metadata, and what features a FAIR-compliant metadata schema should have. We will mainly focus on computational materials-science data and propose a constructive approach for the FAIRification of the (meta)data related to ground-state and excited-states calculations, potential-energy sampling, and generalized workflows. Finally, challenges with the FAIRification of experimental (meta)data and materials-science ontologies are presented together with an outlook of how to meet them

Experimental investigation of hydrodynamics of melt layer during laser cutting of steel

In laser cutting process, understanding of hydrodynamics of melt layer is significant, because it is an important factor which controls the final quality. In this work, we observed hydrodynamics of melt layer on kerf front in the case of laser cutting of steel with inert gas. The observation shows that the melt flow on the kerf front exhibits strong instability, depending on cutting velocity. In intermediate range of velocity, the flow on the central part of the kerf front is continuous, whereas the flow along the sides is discontinuous. It is firstly confirmed that the instability in the side flow is the cause of the striation initiation from the top part of the kerf. The origin of the instability is discussed in terms of instabilities in thermal dynamics and hydrodynamics. The proposed model shows reasonable agreement with experimental results