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  • Committer: Package Import Robot
  • Author(s): Anton Gladky
  • Date: 2015-04-29 23:44:49 UTC
  • mfrom: (5.1.3 experimental)
  • Revision ID: package-import@ubuntu.com-20150429234449-mbhy9utku6hp6oq8
Tags: 0~20150313.gitfa668e1-1
Upload into unstable.

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examples/USER/eff/Li-solid/in.Li.bohr
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pair_style      eff/cut 20.88 limit/eradius pressure/evirials
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pair_coeff      * *
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communicate     single vel yes
 
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comm_modify     vel yes
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neigh_modify    one 2000 page 20000
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fix             0 all temp/rescale/eff 1 0.0 3000.0 0.02 0.5
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fix             1 all npt/eff temp 3000.0 3000.0 0.1 iso 1e7 1e7 1.0
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dump            1 all custom 100 ${sname}.spe.lammpstrj id type q spin eradius x y z
 
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compute         1 all property/atom spin eradius
 
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dump            1 all custom 1 ${sname}.spe.lammpstrj &
 
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                id type q c_1[1] c_1[2] x y z
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run             1000
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