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Adding LAMMPS computes for MACE descriptors and descriptor gradients. - #70

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Fraser-Birks wants to merge 22 commits into
wcwitt:mainfrom
Fraser-Birks:compute_descriptors
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Adding LAMMPS computes for MACE descriptors and descriptor gradients.#70
Fraser-Birks wants to merge 22 commits into
wcwitt:mainfrom
Fraser-Birks:compute_descriptors

Fix compute_symmetrix_maced_atom.cpp sizing size_peratom_cols before …

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symmetrix
failed Jul 29, 2026 in 1m 38s