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conda create deepmd-kit=*=cpu libdeepmd==*cpu lammps -c https://conda.deepmodeling.com -n deepmd -y [shuoxing@node01 02.lmp]$ conda activate deepmd
in.lammps: gas phase methaneunits metal neighbor 1.0 bin read_data conf.lmp pair_style deepmd graph-compress.pb velocity all create 50.0 23456789 thermo_style custom step pe ke etotal temp press vol run 5000 log.lammps: gas phase methaneunits metal neighbor 1.0 bin read_data conf.lmp pair_style deepmd graph-compress.pb
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I think the error message is clear enough. |
Beta Was this translation helpful? Give feedback.
I think the error message is clear enough.