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Implement dumping QM region to xyz trajectory #74

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Implement dumping QM region to xyz trajectory

Implement dumping QM region to xyz trajectory #74

Triggered via pull request April 5, 2024 21:29
@kzinovjevkzinovjev
opened #8
kzinovjev:main
Status Success
Total duration 4m 12s
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main.yaml

on: pull_request
pre_job
3s
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Matrix: build
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4 warnings
build (3.10, linux)
Node.js 16 actions are deprecated. Please update the following actions to use Node.js 20: conda-incubator/setup-miniconda@v2. For more information see: https://github.blog/changelog/2023-09-22-github-actions-transitioning-from-node-16-to-node-20/.
build (3.10, linux)
Mamba support is still experimental and can result in differently solved environments!
build (3.9, linux)
Node.js 16 actions are deprecated. Please update the following actions to use Node.js 20: conda-incubator/setup-miniconda@v2. For more information see: https://github.blog/changelog/2023-09-22-github-actions-transitioning-from-node-16-to-node-20/.
build (3.9, linux)
Mamba support is still experimental and can result in differently solved environments!