Published July 8, 2021
| Version 1.1.0
Standard
Open
The OPTIMADE Specification
Creators
-
Andersen, Casper1
-
Armiento, Rickard2
- Blokhin, Evgeny
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Conduit, Gareth3
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Dwaraknath, Shyam4
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Evans, Matthew L5
- Fekete, Adam6
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Gopakumar, Abhijith7
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Gražulis, Saulius8
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Hegde, Vinay7
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Horton, Matthew4
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Merkys, Andrius8
- Mohamed, Fawzi9
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Morris, Andrew10
- Oses, Corey11
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Pizzi, Giovanni1
- Purcell, Thomas9
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Rignanese, Gian-Marco6
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Scheffler, Matthias12
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Scheidgen, Markus12
- Talirz, Leopold1
- Toher, Cormac11
- Uhrin, Martin1
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Winston, Donald
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Wolverton, Chris7
- 1. EPFL
- 2. Linköping University
- 3. University of Cambridge
- 4. Lawrence Berkeley National Laboratory
- 5. University of Cambridge, UCLouvain
- 6. UCLouvain
- 7. Northwestern University
- 8. Vilnius University Institute of Biotechnology
- 9. Fritz Haber Institute
- 10. University of Birmingham
- 11. Duke University
- 12. Fritz Haber Institute; Humboldt University of Berlin
Description
The Open Databases Integration for Materials Design (OPTIMADE) consortium aims to make materials databases interoperational by developing a common REST API.
This repository contains the specification of the OPTIMADE API.
- optimade.rst: The API specification.
- AUTHORS: List of contributors.
- optimade.org: Public OPTIMADE web site
- OPTIMADE wiki: Information for developers
The subdirectory schemas/ contains OpenAPI schemas for the main OPTIMADE API and index meta-database as implemented by the optimade-python-tools repository. Note: These schemas are an approximation of the full human-readable specification and may be missing certain constraints. Furthermore, they may not be up to date in the develop branch of this repository.
Files
OPTIMADE-1.1.0.zip
Files
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Additional details
Related works
- Is described by
- Journal article: 10.1038/s41597-021-00974-z (DOI)