4.7 Article

OPTIMADE, an API for exchanging materials data

期刊

SCIENTIFIC DATA
卷 8, 期 1, 页码 -

出版社

NATURE PORTFOLIO
DOI: 10.1038/s41597-021-00974-z

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资金

  1. MARVEL National Centre of Competence in Research - Swiss National Science Foundation [51NF40-182892]
  2. European Centre of Excellence MaX Materials design at the Exascale [824143]
  3. MARKETPLACE H2020 project [760173]
  4. Swedish e-Science Research Centre (SeRC)
  5. Swedish Research Council (VR) [2016-04810, 2020-05402]
  6. European Union's Horizon 2020 Research and Innovation Program [654360 NFFA-EUROPE, 689868]
  7. Royal Society
  8. U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Materials Sciences and Engineering Division [DE-AC02-05-CH11231]
  9. European Union's Horizon 2020 research and innovation program under the European Union's Grant agreement [951786]
  10. EPSRC CDT in Computational Methods for Materials Science [EP/L015552/1]
  11. Toyota Research Institute
  12. U.S. Department of Commerce, National Institute of Standards and Technology, Center for Hierarchical Materials Design (CHiMaD) [70NANB14H012]
  13. MICCoM, as part of the Computational Materials Sciences Program - U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division
  14. EPSRC [EP/M022595/1, EP/T026642/1]
  15. EPSRC High-End Computing Consorium, UKCP [EP/P022561/1]
  16. F.R.S.-FNRS
  17. European Union's Horizon 2020 research and innovation program under the European Union's Grant [676580]
  18. Max Planck research network on big-data-driven materials science (BiGmax)
  19. DOD-ONR [N00014-17-1-2090, N00014-17-1-2876]
  20. National Science Foundation under DMREF Grant [DMR-1921909]
  21. National Key Research and Development Program of China [2017YFB0701702, 2016YFB0700501]
  22. Swedish Research Council [2016-04810, 2020-05402] Funding Source: Swedish Research Council
  23. EPSRC [EP/T026642/1, EP/M022595/1] Funding Source: UKRI
  24. Vinnova [2016-04810] Funding Source: Vinnova

向作者/读者索取更多资源

The OPTIMADE consortium has developed a universal API to make materials databases accessible and interoperable. The first stable release v1.0 is supported by leading databases and software packages, and advantages of the API are illustrated through examples on public materials databases.
The Open Databases Integration for Materials Design (OPTIMADE) consortium has designed a universal application programming interface (API) to make materials databases accessible and interoperable. We outline the first stable release of the specification, v1.0, which is already supported by many leading databases and several software packages. We illustrate the advantages of the OPTIMADE API through worked examples on each of the public materials databases that support the full API specification.

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