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List outputs#454

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ElliottKasoar wants to merge 23 commits intostfc:mainstfc/janus-core:mainfrom ElliottKasoar:list-outputsElliottKasoar/janus-core:list-outputsCopy head branch name to clipboard

+898-245

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Commits on Mar 3, 2025

• Always return absolute filename

  ElliottKasoar

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  452e5ad

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• Add output files property to calculations

  ElliottKasoar

  committed
  0e16a2f

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• Save output files to CLI summary

  ElliottKasoar

  committed
  d45c4e8

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• Fixup calcs

  ElliottKasoar

  committed
  c527fee

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• Fixup phonons calc

  ElliottKasoar

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  14f9cde

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• Fixup calcs neb

  ElliottKasoar

  committed
  3bf54a0

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• Save MD postprocessing filenames

  ElliottKasoar

  committed
  214243e

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• Add output files to missing CLI functions

  ElliottKasoar

  committed
  ef0a236

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• Fix Mixin tests

  ElliottKasoar

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  1d581b1

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• Remove duplicate geomopt traj and fix output files

  ElliottKasoar

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  4b1b8df

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• Tidy building filenames

  ElliottKasoar

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  230e055

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• Test output files

  ElliottKasoar

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  261c996

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• Fix saving MD restart files

  ElliottKasoar

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  0631457

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• Fix MD minimize filename

  ElliottKasoar

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  6979608

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• Fix checking lists of output files

  ElliottKasoar

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  9ae9aee

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• Fix MD restart files list

  ElliottKasoar

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  aa9181b

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• Fix inconsistent paths

  ElliottKasoar

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  4a863ef

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• Fix local path

  ElliottKasoar

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  1a1e523

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• Fix docstring

  ElliottKasoar

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  9ce55f6

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• Fix phonon output files

  ElliottKasoar

  committed
  9b154b8

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• Fix phonon output file tests

  ElliottKasoar

  committed
  26d651b

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• Fix writing tuples in CLI summary

  ElliottKasoar

  committed
  cec488e

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• Apply suggestions from code review

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  ElliottKasoar

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  oerc0122

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