mlipx recipes neb --models mace_mp,sevennet,orb_v2,chgnet,mattersim --datapath ../data/neb_end_p.xyz --repro
mlipx compare --glob "*NEBs"
Files
neb
Folders and files
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parent directory.. | ||||
Name | Name | Last commit date | ||
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parent directory.. | ||||
mlipx recipes neb --models mace_mp,sevennet,orb_v2,chgnet,mattersim --datapath ../data/neb_end_p.xyz --repro
mlipx compare --glob "*NEBs"