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Added fix_species

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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9517 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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athomps
2013-02-15 21:29:41 +00:00
parent c9bf647a4a
commit edc95d9a42
1 changed files with 2 additions and 2 deletions
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examples/reax/in.reaxc.tatb
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@ -31,6 +31,7 @@ neigh_modify delay 0 every 5 check no
fix 1 all nve
fix 2 all qeq/reax 1 0.0 10.0 1.0e-6 reax/c
#fix 3 all reax/c/bonds 1 3 5 bonds.reaxc
thermo 5
thermo_style custom step temp epair etotal press &
@ -45,7 +46,6 @@ timestep 0.0625
# axes yes 0.8 0.02 view 60 -30
#dump_modify 1 pad 3
fix 3 all reax/c/bonds 1 1 25 bonds.reaxc.tatb
fix 3 all species 1 5 5 species.tatb
run 25