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Releases: SMTG-Bham/sumo

v2.2.5

04 Jun 09:16
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Bugfix: Fixed colour parsing for BS + DOS plots. (@kavanse)

v2.2.4

06 May 16:44
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Bugfix: sumo-kgen with --hybrid but without --folders now asks whether to
split up the k-points.

v2.2.3

15 Apr 16:45
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Bugfix: Questaal band structure import was consistently raising unnecessary Exception

v2.2.2

25 Mar 01:39
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Added Latimer-Munro high-symmetry k-point paths. (@kavanase)

v2.2.1

14 Jan 17:30
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Fixed typo in sumo-bandplot.

v2.2.0

14 Jan 17:20
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  • Support is added for orbital-projected DOS plots from CASTEP. (@zhubonan)

    • The binary parser is implemented and maintained in a separate
      library castepxbin. This is maintained by Bonan Zhu, available on
      PyPI and pinned to a specific version in the Sumo setup.py.

Enhancements:

  • normalise option added to bandplot to control the normalisation of orbital
    projections. The default has been changed from select to all, meaning that
    the size of projections is normalised against the sum of all other projections
    at that band and k-point. (@utf)

v2.1.1

22 Nov 20:06
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Enhancements:

  • Band structure grid lines can now be customised using a matplotlib
    style sheet.

v2.1.0

03 Nov 17:42
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Sumo is now python 3.6+ only.

Additional bug fixes:

  • Fix band structure interpolation with small branches (@kavanase)
  • Update pymatgen version requirement.

v2.0.2

20 Oct 00:55
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New testing and release framework.

v2.0.1

19 Oct 22:14
@utf utf
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Bug fixes:

  • Fixed support for pymatgen versions > 2020.10.9.1 (@utf)
  • Fix yaml phonon-bandstructure plotting (@kavanase)