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Vasp GPU (single node) podman#4

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tonykew wants to merge 34 commits intoubccr:mainubccr/ccr-examples:mainfrom tonykew:VASP-podmantonykew/ccr-examples:VASP-podmanCopy head branch name to clipboard

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Commits on Sep 18, 2024

• Initial check in of VASP-GPU-podman example

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• Fixed typos

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• Merge pull request #1 from tonykew/VASP-podman

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• Fixed wget URLs

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• Merge pull request #2 from tonykew/VASP-podman

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• Made build script executable

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• Merge pull request #3 from tonykew/VASP-podman

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• Added copying the VASP tarball to ${SLURMTMPDIR}

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• Merge pull request #4 from tonykew/VASP-podman

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• Make fix_nvhpc_.pc_files.bash script executable

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• Merge pull request #5 from tonykew/VASP-podman

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Commits on Sep 19, 2024

• Update salloc for parallel build

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• Merge pull request #6 from tonykew/VASP-podman

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• Fix typos

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• Merge pull request #7 from tonykew/VASP-podman

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• Add output with the path to the sample Slurm script

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• Merge pull request #8 from tonykew/VASP-podman

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• Fix typo

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• Merge pull request #9 from tonykew/VASP-podman

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• Fix (another!) typo

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• Merge pull request #10 from tonykew/VASP-podman

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• Initial check in of VASP-GPU-podman example

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• Merge branch 'main' into VASP-podman

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• Merge pull request #11 from tonykew/VASP-podman

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• Use "id -un" for the username rather than the LOGNAME variable

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• Merge branch 'main' into VASP-podman

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• Merge pull request #12 from tonykew/VASP-podman

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Commits on Dec 5, 2024

• Changes to clarify usage

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Commits on Dec 6, 2024

• SCript trimming

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• Update README to match the updated SLURM sample script

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• Cosmetic changes to README.md

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• Readability changes

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• Path name changes

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• Remove all RPCI references

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