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Commits on Aug 29, 2025

• Add new color maps to colormaps_default.json

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Commits on Jul 15, 2025

• Had to bump version because build files for pypi where wrong

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  e96afe9

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• Exlcuded PySide6 version 6.9.* because it has a bug on windows, throwing null pointer passed errors

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Commits on Jul 7, 2025

• Allowed orientation angles on the orbitaldatatab from -180 to 180

  

  Dominik Brandstetter

  committed
  4067a57

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Commits on Jan 27, 2025

• Fixed symmetrization bug.

  

  Dominik Brandstetter

  committed
  8511223

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Commits on Jan 15, 2025

• Removed old builds

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  9e67818

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• Update the meta data name to comply with PEP625

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  7b723db

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• Fixed error on startup without internet connection

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Commits on Dec 18, 2024

• Builds

  

  Dominik Brandstetter

  committed
  91a734b

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• Fixed tests

  

  Dominik Brandstetter

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  35ca772

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Commits on Dec 11, 2024

• Added an automatic update of the molecule database file when the program is started.

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  Dominik Brandstetter

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  1b34923

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• Added update checker

  

  Dominik Brandstetter

  committed
  177ce98

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Commits on Nov 5, 2024

• Allowing azimuth to go from 0 to 360 and angle from 0 to 90.

  

  Dominik Brandstetter

  committed
  64601e8

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• fixed numpy nan deprication

  

  Dominik Brandstetter

  committed
  ae44f9c

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• Changed alpha to angle and beta to azimuth

  

  Dominik Brandstetter

  committed
  0844c80

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• Possible fix for Windows git bug

  

  Dominik Brandstetter

  committed
  903aad7

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Commits on Oct 31, 2024

• Bug fix

  

  Dominik Brandstetter

  committed
  3ab7c60

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• Possible fix for high res monitors with horizontal scroll bar in orbitaldata tab

  

  Dominik Brandstetter

  committed
  6ab442e

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• Added support for dset_ids flags in .cube files like written by Orca

  

  Dominik Brandstetter

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Commits on Oct 30, 2024

• Added Mac files to .gitignore

  

  Dominik Brandstetter

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  e663171

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Commits on Jul 22, 2024

• Minor Bugfix

  

  Dominik Brandstetter

  committed
  18c3b90

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Commits on Jun 7, 2024

• Updated molecules database file

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  b244408

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Commits on Dec 14, 2023

• Added Gaussian fitting (not UI; by Peter)

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  22e5741

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Commits on Dec 13, 2023

• Update to Makefile only.

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  5b8b386

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• Fixed bug when fitting one slice with matrix inversion that is not the

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  07a9655

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• Fixed bug when opening plot if not all orbitals were fitted

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  6138b15

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Commits on Dec 7, 2023

• Fixed the kinetic energy spinbox on the OrbitalDataTab

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  db51267

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• Fixed bug where matrix inversion will not work if only a subset of

  Show description for 93275a0
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  93275a0

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Commits on Dec 4, 2023

• Removed old builds.

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  2345b2a

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• Standard deviation of fitting parameters will now be displayed

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• .gitignore

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  b3ab4b9

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• Matrix inversion fits now estimate the standard deviation of the fitting

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Commits on Nov 24, 2023

• Added builds for 3.0.4

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  fa3e306

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• Added the constant background to the lmfitresult plot.

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  6436750

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• Improved covariance matrix output.

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