forked from lijiext/lammps
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12476 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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# 3d Lennard-Jones melt
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newton off
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package gpu force/neigh 0 1 1
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package gpu 1
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variable x index 2
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variable y index 2
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# 3d Lennard-Jones melt
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newton off
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package gpu force/neigh 0 1 1 threads_per_atom 8
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package gpu 1 tpa 8
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variable x index 2
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variable y index 2
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# GI-System
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units metal
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newton off
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package gpu force/neigh 0 1 1
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package gpu 1
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atom_style charge
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read_data data.phosphate
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# Rhodopsin model
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newton off
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package gpu force/neigh 0 1 1
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package gpu 1
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variable x index 2
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variable y index 2
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# cutoff 4.0 with skin 0.8
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# NPT, T=2.4, P=8.0
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package intel * mixed balance $b
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package omp *
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package intel 1 prec mixed balance $b
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package omp 0
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suffix $s
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processors * * * grid numa
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# Rhodopsin model
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package intel * mixed balance $b
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package omp *
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package intel 1 prec mixed balance $b
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package omp 0
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suffix $s
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variable x index 4
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