All pull requests

Pull requests

• Add optional CDXML structure importer

  #1599·cpignedoli opened Oct 3, 2026Member·

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  1

• Implement constraint-aware plugin management

  #1598·edan-bainglass opened Oct 1, 2026Member·

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  8

• Fix results summary for imported calculations with missing pseudopotential references

  #1596·cpignedoli opened Sep 30, 2026Member·

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  1

  2

• Add aiida-qe-converse plugin (NMR shielding + EFG/NQR quadrupolar parameters)

  #1547·moritzgubler opened Jul 31, 2026·

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  5

• 🔍 Try running CI vs 5.0.0rc1

  #1471·mbercx opened Apr 1, 2026Member·

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  3

• Feature/onlyfixedatoms

  #1440·cpignedoli opened Dec 1, 2025Member·

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  1

• Addign editor to fix atomic positions in x,y,z and to add constraints

  #1397·cpignedoli opened Sep 17, 2025Member·

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  13

• Fix width in fat bands

  #1340·t-reents opened Jun 29, 2025Collaborator·

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  4

• Also add arm test

  #1280·superstar54 opened Apr 5, 2025Member·

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• [Docs] Add event section and PSI school 2025

  #1198·superstar54 opened Mar 6, 2025Member·

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  1

• Provide get_workchain_metadata help function

  #1173·superstar54 opened Feb 19, 2025Member·

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  1

• Bump jinja2 from 3.1.4 to 3.1.5 in /docs

  dependenciespython
  #1033·dependabot[bot] opened Dec 24, 2024Bot·

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  1

• Bump the gha-dependencies group across 1 directory with 4 updates

  dependenciesgithub_actions
  #964·dependabot[bot] opened Dec 1, 2024Bot·

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  1

• Lazy-docs

  #919·edan-bainglass opened Nov 8, 2024Member·

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  9

• Docs: How to search for jobs

  #680·superstar54 opened Apr 24, 2024Member·

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  1

• Run one SCF calculation for all plugins

  #631·superstar54 opened Mar 5, 2024Member·

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  3

• Apply mypy for checking

  #594·unkcpz opened Jan 17, 2024Member·

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  1

• providing a subsection in developer guide docs, about automatic code installation

  #576·mikibonacci opened Dec 5, 2023Member·

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  10

• Fix/remove deprecations

  #519·unkcpz opened Oct 20, 2023Member·

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  2