forked from lijiext/lammps
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11983 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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@ -22,7 +22,7 @@ timestep 0.001
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fix 1 all nve/awpmd
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communicate single vel yes
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comm_modify vel yes
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compute energies all pair awpmd/cut
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variable eke equal c_energies[1]
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@ -22,7 +22,7 @@ timestep 0.001
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fix 1 all nve/awpmd
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communicate single vel yes
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comm_modify vel yes
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compute energies all pair awpmd/cut
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variable eke equal c_energies[1]
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@ -37,7 +37,7 @@ atom_modify first charged
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kspace_style pppm/cg 0.00001
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kspace_modify order 3
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communicate multi
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comm_modify mode multi
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neighbor 2.0 multi
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neigh_modify delay 4 every 2 check yes
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@ -7,7 +7,7 @@ atom_style bond
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atom_modify sort 0 1.
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bond_style harmonic
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pair_style none
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communicate single cutoff 2.0
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comm_modify cutoff 2.0
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# geometry
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read_data data.pos
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@ -7,7 +7,7 @@ atom_style bond
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atom_modify sort 0 1.
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bond_style harmonic
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pair_style none
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communicate single cutoff 2.0
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comm_modify cutoff 2.0
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# geometry
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read_data data.pos
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@ -20,7 +20,7 @@ velocity all create 1.44 87287 loop geom
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neighbor 1 multi
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neigh_modify delay 0
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communicate multi
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comm_modify mode multi
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# colloid potential
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@ -3,7 +3,7 @@
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atom_style sphere
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boundary p p fm
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newton off
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communicate single vel yes
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comm_modify vel yes
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region reg block -10 10 -10 10 -0.5 16 units box
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create_box 1 reg
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@ -4,7 +4,7 @@ dimension 2
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atom_style sphere
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boundary f fm p
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newton off
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communicate single vel yes
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comm_modify vel yes
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region reg block 0 100 0 50 -0.5 0.5 units box
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create_box 1 reg
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@ -5,7 +5,7 @@ atom_style sphere
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atom_modify map array
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boundary f fm p
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newton off
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communicate single vel yes cutoff 2.5
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comm_modify vel yes cutoff 2.5
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fix prop all property/atom mol
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@ -65,7 +65,7 @@ reset_timestep 0
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neighbor 0.3 bin
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neigh_modify delay 0 every 1 check yes
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communicate multi group big vel yes
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comm_modify mode multi group big vel yes
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neigh_modify include big
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# no pairwise interactions with small particles
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@ -28,7 +28,7 @@ velocity all create 1.0 593849 loop geom
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neighbor 0.3 bin
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neigh_modify delay 1 every 1 check no
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communicate single group empty
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comm_modify group empty
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# timestep is big and SRD frequency is 1
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