Code

Unified error calculation#560

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Merged

RandomDefaultUser merged 11 commits intodevelopmala-project/mala:developfrom uniform_error_calculationmala-project/mala:uniform_error_calculationCopy head branch name to clipboardOct 7, 2024

+972-873

Commits

Commits on Jul 17, 2024

• Unified error calculation

  

  nerkulec

  committed
  4139713

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Commits on Jul 22, 2024

• Fix error saving

  

  nerkulec

  committed
  4a3f56d

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• Updated .gitignore

  

  nerkulec

  committed
  a9925b2

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• Fix UnboundLocal error

  

  nerkulec

  committed
  049d51d

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Commits on Jul 26, 2024

• Merge branch 'develop' into uniform_error_calculation

  RandomDefaultUser

  authored
  44fd34a

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• Miniscule error in docstring

  RandomDefaultUser

  committed
  f392ee7

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Commits on Aug 21, 2024

• Added tqdm

  

  nerkulec

  committed
  5239d4c

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• Remove energy calculations with DFT fermi energy

  

  nerkulec

  committed
  515c165

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• Fixed exceptions and added missing band_energy_actual_fe calculation

  

  nerkulec

  committed
  7b093b5

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• Remove unused fe_dft

  

  nerkulec

  committed
  29fab9a

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• Get energy targets and predictions

  

  nerkulec

  committed
  24f9f62

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