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Data Reproducibility and Traceability forCommunity Materials Databases: Qresp for MatD3

Jan 16, 2020
Scientific Achievement: The interfaces of the Qresp and MatD3 software packages (http://www.qresp.org/ and  https://github.com/HybriD3-database/MatD3) have been connected and extended for research data reproducibility and availability.

Significance and Impact: The availability of the combined Qresp-MatD3 solution will enable the community to take a significant step forward in making available the vast trove of newly generated materials research data for validation and reuse, in a distributed fashion.
Scientific Achievement: The interfaces of the Qresp and MatD3 software packages (http://www.qresp.org/ and https://github.com/HybriD3-database/MatD3) have been connected and extended for research data reproducibility and availability. Significance and Impact: The availability of the combined Qresp-MatD3 solution will enable the community to take a significant step forward in making available the vast trove of newly generated materials research data for validation and reuse, in a distributed fashion.

Materials data from individual research groups is traditionally disseminated by means of loosely interconnected, peer-reviewed publications. The combined Qresp MatD3 solution allows researchers to enter their data as well as associated publication and reproducibility information in a single workflow: i) Creation of a MatD3 entry with simultaneous generation of the corresponding metadata for Qresp curation and exploration;  ii) Generation of Qresp metadata for an already existing MatD3 entry, and iii) Generation of MatD3 entries from Qresp metadata.

U.S. National Science Foundation and NSF DMREF, Materials for Our Future

This material is based upon work supported by the U.S. National Science Foundation Award No. 2015237. Any opinions, findings, and conclusions or recommendations expressed in this material are those of the author(s) and do not necessarily reflect the views of the U.S. National Science Foundation. This site is maintained collaboratively by principal investigators with NSF DMREF awards, independent of the NSF.