Change log#

v0.2.5#

  • Fix symmetry-adapted displacements for noisy and lower-symmetry inputs [#27]

    • Require spgrep>=0.3.3 for robust treatment for selecting symmetry-adapted bases

v0.2.4#

  • Fix get_translational_subgroup() for Gamma point

v0.2.3#

Initial release to PyPI

  • Calculate representation matrices and irreps formed by phonon eigenmodes

  • Calculate isotropy subgroups of irreps of space groups on the fly

  • Generate modulated structures in selected order-parameter directions of isotropy subgroups