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Package providing base types for representing/manipulating periodic crystal structures.

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zhubonan/CellBase.jl

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CellBase

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Base code and routines for building/manipulating periodic crystal structures. Hopefully useful for more complex projects with specific applications.

Goal

  1. Ease to use - don't make things unnecessary complex.
  2. High performance - when it is needed.
  3. Extensibility and flexibility.

Acknowledgement

Elemental datasets are taken from the SMACT package.

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Package providing base types for representing/manipulating periodic crystal structures.

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