34 lines
616 B
Plaintext
34 lines
616 B
Plaintext
# Vesicle demo
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variable T equal 0.2
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variable LD equal 1.0
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units lj
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atom_style ellipsoid
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boundary p p p
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read_data read_data.vesicle1026
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compute ali all temp/com
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compute rott all temp/asphere bias ali
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velocity all create ${T} 87287 loop geom
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pair_style ylz 2.6
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pair_coeff * * 1.0 1.0 4 3 0.0 2.6
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neighbor 1.0 bin
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thermo_style custom step temp press pxx pyy
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thermo 200
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timestep 0.001
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#dump 1 all atom 10 onlymembrane2.lammpstrj
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fix 1 all langevin ${T} ${T} ${LD} 48279
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fix 2 all nve/asphere
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run 3000
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