Software Open Access

SMACT: Semiconducting Materials by Analogy and Chemical Theory

Dan Davies; Keith Butler; Adam J. Jackson; Jonathan Skelton; Kazuki Morita; Aron Walsh

This release follows peer review of the package in the Journal of Open Source Software (see the full open review process here).

Most important changes include:

  • Updating the README to make it more user-friendly, especially for those new to the field.
  • Consolidating and improving the examples.
  • Updating the docs and fixing typos.
  • Renaming the smact_test function to smact_filter.

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WMD-group/SMACT-v2.1.zip
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