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  1. Tools for implementing and consuming OPTIMADE APIs in Python

    Python 26 20

  2. Specification of a common REST API for access to materials databases

    Makefile 36 23

  3. ⚗️ matador is an aggregator, manipulator and runner of first-principles calculations, written with a bent towards battery 🔋 electrode materials.

    Python 14 9

  4. High-throughput crystal structure prediction with genetic algorithms.

    Python 1 1

  5. An OPTIMADE implementation for @AJMGroup using

    Python 2

  6. An introduction to git and version control, initially written for the Part II Computational Physics course at the Cavendish Laboratory.

    Jupyter Notebook 6 2

1,156 contributions in the last year

Jul Aug Sep Oct Nov Dec Jan Feb Mar Apr May Jun Jul Mon Wed Fri

Contribution activity

July 2021

Created 2 repositories

Created a pull request in Materials-Consortia/optimade-python-tools that received 10 comments

Update elements description to match specification

This PR preempts the upcoming change to the specification.

+10 −10 10 comments
Opened 9 other pull requests in 4 repositories

Created an issue in Materials-Consortia/schemas that received 12 comments

How should these schemas be updated?

Since the release of v1.0.0, we have made improvements to the schema, whilst still following the release text. Should we update the schemas here wi…

Opened 5 other issues in 4 repositories
1 open 1 closed
1 open
1 open
1 open

Joined the MaRDA DataDicts WG organization

MaRDA DataDicts WG

Materials Research Data Alliance (MaRDA) Data Dictionaries Working Group (WG)

28 contributions in private repositories Jul 5 – Jul 22

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