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| software:vasp:darwin [2024-11-12 16:48] – anita | software:vasp:darwin [2024-11-12 16:49] (current) – anita |
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| ====== VASP on DARWIN ====== | ====== VASP on DARWIN ====== |
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| For building VASP version 6, please review [[technical:recipes:vasp-6-darwin| building VASP 6 on Caviness/DARWIN]] documentation. Please see [[https://github.com/jtfrey/vasp-dynamic-mpi-block-patch|VASP: Dynamic MPI_BLOCK patch]] as this patch modifies the source code to dynamically-allocate the four arrays according to the integer-valued VASP_MPI_BLOCK environment variable, with the compiled-in MPI_BLOCK acting as the default. | For building VASP version 6, please review [[technical:recipes:vasp-6-darwin| building VASP 6 on Caviness/DARWIN]] documentation. Please see [[https://github.com/jtfrey/vasp-dynamic-mpi-block-patch|VASP: Dynamic MPI_BLOCK patch]]: a patch to VASP to make MPI_BLOCK configurable via an environment variable. |