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Upgrade QE to 7.4 in docker image #1119

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merged 2 commits into from
Jan 30, 2025

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@superstar54 superstar54 commented Jan 30, 2025

This Pr upgrades QE to 7.4

  • QE inside the docker image
  • QE inside AiiDA code setup

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codecov bot commented Jan 30, 2025

Codecov Report

All modified and coverable lines are covered by tests ✅

Project coverage is 70.94%. Comparing base (5a32a7b) to head (c09264b).
Report is 2 commits behind head on main.

Additional details and impacted files
@@           Coverage Diff           @@
##             main    #1119   +/-   ##
=======================================
  Coverage   70.94%   70.94%           
=======================================
  Files         115      115           
  Lines        7158     7158           
=======================================
  Hits         5078     5078           
  Misses       2080     2080           
Flag Coverage Δ
python-3.11 70.92% <100.00%> (-0.02%) ⬇️
python-3.9 70.94% <100.00%> (+0.01%) ⬆️

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@superstar54
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Hi @edan-bainglass , I tested the image locally with Si + relax + bands + pdos, and it works.

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LGTM!

@superstar54 superstar54 merged commit 2ee76fb into aiidalab:main Jan 30, 2025
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@superstar54 superstar54 deleted the update_docker_qe_version branch January 30, 2025 16:25
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2 participants