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Force pp="PBE" when using the PBE pseudopotentials #16619

Force pp="PBE" when using the PBE pseudopotentials

Force pp="PBE" when using the PBE pseudopotentials #16619

Triggered via pull request March 12, 2026 22:43
Status Success
Total duration 7m 52s
Artifacts 17

tests.yaml

on: pull_request
Matrix: tests-core
Matrix: tests-engines
tests-psi4
2m 6s
tests-psi4
tests-defects-phonons-espresso
4m 49s
tests-defects-phonons-espresso
tests-tblite-dftbplus
2m 25s
tests-tblite-dftbplus
tests-qchem-sella
2m 31s
tests-qchem-sella
tests-sevenn-orb-newtonnet
7m 25s
tests-sevenn-orb-newtonnet
tests-mace-matgl
2m 30s
tests-mace-matgl
tests-fairchem
2m 20s
tests-fairchem
tests-mp
1m 0s
tests-mp
tests-torchsim
1m 55s
tests-torchsim
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11 warnings
tests-psi4
Node.js 20 actions are deprecated. The following actions are running on Node.js 20 and may not work as expected: conda-incubator/setup-miniconda@v3. Actions will be forced to run with Node.js 24 by default starting June 2nd, 2026. Please check if updated versions of these actions are available that support Node.js 24. To opt into Node.js 24 now, set the FORCE_JAVASCRIPT_ACTIONS_TO_NODE24=true environment variable on the runner or in your workflow file. Once Node.js 24 becomes the default, you can temporarily opt out by setting ACTIONS_ALLOW_USE_UNSECURE_NODE_VERSION=true. For more information see: https://github.blog/changelog/2025-09-19-deprecation-of-node-20-on-github-actions-runners/
tests-psi4
The 'defaults' channel might have been added implicitly. If this is intentional, add 'defaults' to the 'channels' list. Otherwise, consider setting 'conda-remove-defaults' to 'true'.
tests-tblite-dftbplus
Node.js 20 actions are deprecated. The following actions are running on Node.js 20 and may not work as expected: conda-incubator/setup-miniconda@v3. Actions will be forced to run with Node.js 24 by default starting June 2nd, 2026. Please check if updated versions of these actions are available that support Node.js 24. To opt into Node.js 24 now, set the FORCE_JAVASCRIPT_ACTIONS_TO_NODE24=true environment variable on the runner or in your workflow file. Once Node.js 24 becomes the default, you can temporarily opt out by setting ACTIONS_ALLOW_USE_UNSECURE_NODE_VERSION=true. For more information see: https://github.blog/changelog/2025-09-19-deprecation-of-node-20-on-github-actions-runners/
tests-tblite-dftbplus
The 'defaults' channel might have been added implicitly. If this is intentional, add 'defaults' to the 'channels' list. Otherwise, consider setting 'conda-remove-defaults' to 'true'.
tests-qchem-sella
Node.js 20 actions are deprecated. The following actions are running on Node.js 20 and may not work as expected: conda-incubator/setup-miniconda@v3. Actions will be forced to run with Node.js 24 by default starting June 2nd, 2026. Please check if updated versions of these actions are available that support Node.js 24. To opt into Node.js 24 now, set the FORCE_JAVASCRIPT_ACTIONS_TO_NODE24=true environment variable on the runner or in your workflow file. Once Node.js 24 becomes the default, you can temporarily opt out by setting ACTIONS_ALLOW_USE_UNSECURE_NODE_VERSION=true. For more information see: https://github.blog/changelog/2025-09-19-deprecation-of-node-20-on-github-actions-runners/
tests-qchem-sella
The 'defaults' channel might have been added implicitly. If this is intentional, add 'defaults' to the 'channels' list. Otherwise, consider setting 'conda-remove-defaults' to 'true'.
tests-defects-phonons-espresso
Node.js 20 actions are deprecated. The following actions are running on Node.js 20 and may not work as expected: conda-incubator/setup-miniconda@v3. Actions will be forced to run with Node.js 24 by default starting June 2nd, 2026. Please check if updated versions of these actions are available that support Node.js 24. To opt into Node.js 24 now, set the FORCE_JAVASCRIPT_ACTIONS_TO_NODE24=true environment variable on the runner or in your workflow file. Once Node.js 24 becomes the default, you can temporarily opt out by setting ACTIONS_ALLOW_USE_UNSECURE_NODE_VERSION=true. For more information see: https://github.blog/changelog/2025-09-19-deprecation-of-node-20-on-github-actions-runners/
tests-defects-phonons-espresso
The 'defaults' channel might have been added implicitly. If this is intentional, add 'defaults' to the 'channels' list. Otherwise, consider setting 'conda-remove-defaults' to 'true'.
tests-engines (dask)
Node.js 20 actions are deprecated. The following actions are running on Node.js 20 and may not work as expected: conda-incubator/setup-miniconda@v3. Actions will be forced to run with Node.js 24 by default starting June 2nd, 2026. Please check if updated versions of these actions are available that support Node.js 24. To opt into Node.js 24 now, set the FORCE_JAVASCRIPT_ACTIONS_TO_NODE24=true environment variable on the runner or in your workflow file. Once Node.js 24 becomes the default, you can temporarily opt out by setting ACTIONS_ALLOW_USE_UNSECURE_NODE_VERSION=true. For more information see: https://github.blog/changelog/2025-09-19-deprecation-of-node-20-on-github-actions-runners/
tests-engines (dask)
The 'defaults' channel might have been added implicitly. If this is intentional, add 'defaults' to the 'channels' list. Otherwise, consider setting 'conda-remove-defaults' to 'true'.
codecov
Node.js 20 actions are deprecated. The following actions are running on Node.js 20 and may not work as expected: actions/github-script@60a0d83039c74a4aee543508d2ffcb1c3799cdea. Actions will be forced to run with Node.js 24 by default starting June 2nd, 2026. Please check if updated versions of these actions are available that support Node.js 24. To opt into Node.js 24 now, set the FORCE_JAVASCRIPT_ACTIONS_TO_NODE24=true environment variable on the runner or in your workflow file. Once Node.js 24 becomes the default, you can temporarily opt out by setting ACTIONS_ALLOW_USE_UNSECURE_NODE_VERSION=true. For more information see: https://github.blog/changelog/2025-09-19-deprecation-of-node-20-on-github-actions-runners/

Artifacts

Produced during runtime
Name Size Digest
tests-core 3.11 ubuntu-latest coverage report Expired
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tests-core 3.13 ubuntu-latest coverage report Expired
11.2 KB
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tests-core 3.13 windows-latest coverage report Expired
11.2 KB
sha256:cc9bdeb9837f8e805550ef776385cfa62b2695dd249900dfe70dcf6f1cd05f6a
tests-defects-phonons-espresso coverage report Expired
11.4 KB
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tests-engines dask coverage report Expired
11 KB
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tests-engines jobflow coverage report Expired
10.6 KB
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tests-engines parsl coverage report Expired
10.7 KB
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tests-engines prefect coverage report Expired
10.8 KB
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tests-engines redun coverage report Expired
10.7 KB
sha256:2ef3a0d4bf94a451d7d72864a56a660c4ec02ae4f854ce4d324c37f2b9a9873e
tests-fairchem coverage report Expired
11.3 KB
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tests-mace-matgl coverage report Expired
11.2 KB
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tests-mp coverage report Expired
11.3 KB
sha256:302db3c0c66eafb0508a576e21e24cc3a30b6e8c1c51a087b78e711cf802a710
tests-psi4 coverage report Expired
11.1 KB
sha256:c31461bc482491177c5afced34d5c14cbaadafa3d645f566e8c46b044bccba73
tests-qchem-sella coverage report Expired
11.3 KB
sha256:26026136b7e7f69825d471ea37487fb1a903a7d88b749e6ea2309a7038f72cf4
tests-sevenn-orb-newtonnet coverage report Expired
11.4 KB
sha256:844cd713473b155e8eea06133056240d809fac7dcc54d7d159cd5ab76e4b6b11
tests-tblite-dftbplus coverage report Expired
11.3 KB
sha256:f8f66903ab0efe4927275e0064ba708ff88e9934c6c952c846b53dab3edfe879
tests-torchsim coverage report Expired
11.2 KB
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