Towards MatCore: A Unified Metadata Standard for Materials Science

Jane Greenberg; Pamela Boveda-Aguirre; John Allison; Pietro Asinari; Maria Chan; Anand Chandrasekaran; Elif Ertekin; Emmanouel Garoufallou; Giulia Galli; Paolo Giannozzi; Feliciano Giustino; Gerhard Goldbeck; Hendrik Heinz; Arthi Jayaraman; Vincenzo Lordi; Kristin A. Persson; Gian-Marco Rignanese; Aidan Thompson; Eric Toberer; Scott McClellan; Ellad B. Tadmor

arXiv · 2502.07106

Towards MatCore: A Unified Metadata Standard for Materials Science

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Abstract

The materials science community seeks to support the FAIR principles for computational simulation research. The MatCore Project was recently launched to address this need, with the goal of developing an overall metadata framework and accompanying guidelines. This paper reports on the MatCore goals and overall progress. Historical background context is provided, including a review of the principles underlying successful core metadata standards. The paper also presents selected MatCore examples and discusses future plans.

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Jane Greenberg, Pamela Boveda-Aguirre, John Allison, Pietro Asinari, Maria Chan, Anand Chandrasekaran, Elif Ertekin, Emmanouel Garoufallou, Giulia Galli, Paolo Giannozzi, Feliciano Giustino, Gerhard Goldbeck, Hendrik Heinz, Arthi Jayaraman, Vincenzo Lordi, Kristin A. Persson, Gian-Marco Rignanese, Aidan Thompson, Eric Toberer, Scott McClellan, Ellad B. Tadmor. 2025-02-10. Towards MatCore: A Unified Metadata Standard for Materials Science. https://arxiv.org/abs/2502.07106

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