24 lines
441 B
Plaintext
24 lines
441 B
Plaintext
# LAMMPS input for coupling LAMMPS with Python via fix external
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units metal
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dimension 3
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atom_style atomic
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atom_modify sort 0 0.0
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lattice diamond 5.43
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region box block 0 1 0 1 0 1
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create_box 1 box
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create_atoms 1 box
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mass 1 28.08
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velocity all create 300.0 87293 loop geom
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fix 1 all nve
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fix 2 all external pf/callback 1 1
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#dump 2 all image 25 image.*.jpg type type &
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# axes yes 0.8 0.02 view 60 -30
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#dump_modify 2 pad 3
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thermo 1
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