Periodic ab initio calculations - Quality Assurance

Summary

Autoremovals: 2

Migration issues: 1

CI failures: 2

Install issues: 4

No issues: 1/6

DebiChem Periodic Ab Initio Calculations

This metapackage will install packages doing periodic ab initio calculations which might be useful for chemists.

cp2k

😟 Autoremoval

😟 CI

😟 Install/upgrade

Package marked for automatic removal:

  • Will be removed on: 2025-05-27
  • Dependencies leading to autoremoval: spglib
  • Bugs in dependencies leading to autoremoval: #1103017

Continuous integration (CI) tests are failing:

Piuparts failed:

gpaw

😟 Autoremoval

Package marked for automatic removal:

  • Will be removed on: 2025-05-27
  • Dependencies leading to autoremoval: spglib
  • Bugs in dependencies leading to autoremoval: #1103017

abinit

😟 CI

😟 Migration

😟 Install/upgrade

Continuous integration (CI) tests are failing:

Migration from unstable to testing is blocked:

  • Not in testing for 277 days.
  • Verdict: Rejected/violates migration policy/introduces a regression
  • Reason: autopkgtest, block

Piuparts failed:

espresso

😟 Install/upgrade

😑 Tests missing

Piuparts failed:

Continuous integration (CI) tests are missing.

nwchem

😟 Install/upgrade

Piuparts failed: