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Added ase Nudged Elastic Band in the NewtonNet recipe #14403

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Added ase Nudged Elastic Band in the NewtonNet recipe

Added ase Nudged Elastic Band in the NewtonNet recipe #14403

Triggered via pull request January 10, 2025 13:52
@pre-commit-cipre-commit-ci[bot]
synchronize #2176
kumaranu:neb_nn
Status Cancelled
Total duration 32s
Artifacts –

tests.yaml

on: pull_request
Matrix: tests-core
Matrix: tests-engines
tests-psi4
19s
tests-psi4
tests-defects-phonons-espresso
18s
tests-defects-phonons-espresso
tests-tblite-dftbplus
0s
tests-tblite-dftbplus
tests-qchem-sella
18s
tests-qchem-sella
tests-mlps
0s
tests-mlps
tests-mp
0s
tests-mp
codecov
0s
codecov
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Annotations

19 errors and 3 warnings
tests-engines (prefect)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-engines (jobflow)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-engines (dask)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-engines (parsl)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-mlps
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-core (3.10, windows-latest)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-core (3.10, ubuntu-latest)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-tblite-dftbplus
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-defects-phonons-espresso
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-defects-phonons-espresso
The operation was canceled.
tests-core (3.13, ubuntu-latest)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-engines (redun)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-mp
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-qchem-sella
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-qchem-sella
The operation was canceled.
tests-psi4
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-psi4
The operation was canceled.
tests-engines (covalent)
Canceling since a higher priority waiting request for 'tests-refs/pull/2176/merge' exists
tests-engines (covalent)
The operation was canceled.
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-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-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'.