A SEAMM plug-in for setting the periodic (unit) cell.

• Free software: BSD-3-Clause
• Documentation: https://molssi-seamm.github.io/set_cell_step/index.html
• Code: https://github.com/molssi-seamm/set_cell_step

• Setting the cell parameters
  • Explicitly.
  • To a given volume or density.
  • Uniformly expanding or contracting the cell.

This package was created with Cookiecutter and the molssi-seamm/cookiecutter-seamm-plugin project template.

Developed by the Molecular Sciences Software Institute (MolSSI), which receives funding from the National Science Foundation under award OAC-1547580 and CHE-2136142.