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computational_materials_science

The project has been set up to explore Materials science data and get an insight into the efficient-querying method. There are plenty number of scientific database projects. We have selected four repositories and dealt with API and distinctive database system to establish a pipeline to our endpoint.

It encompasses Python, Linux, MySQL, SQLite, MongoDB syntax, SSH Connection and Scientific Domain knowledge.

PPT Resource

List of databases

  1. https://cmr.fysik.dtu.dk/ as folder cmr
  2. https://materialsproject.org/ as folder mp
  3. https://nomad-coe.eu/ as folder nomad
  4. http://oqmd.org/download/ as folder oqmd

Additional resources

Automatic flow http://www.aflow.org/
Material design http://www.optimade.org/