feat: integrate NEP CUDA kernels into MD runner with complete GPU compute path#7526
Open
lijianing-sudo wants to merge 23 commits into
Open
feat: integrate NEP CUDA kernels into MD runner with complete GPU compute path#7526lijianing-sudo wants to merge 23 commits into
lijianing-sudo wants to merge 23 commits into
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Set up Python
WARNING: The directory '/github/home/.cache/pip' or its parent directory is not owned or is not writable by the current user. The cache has been disabled. Check the permissions and owner of that directory. If executing pip with sudo, you should use sudo's -H flag.
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Set up Python
WARNING: Running pip as the 'root' user can result in broken permissions and conflicting behaviour with the system package manager. It is recommended to use a virtual environment instead: https://pip.pypa.io/warnings/venv
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