34 lines
407 B
Plaintext
34 lines
407 B
Plaintext
LAMMPS data file for water
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3 atoms
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0 bonds
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0 angles
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0 dihedrals
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0 impropers
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2 atom types
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0 bond types
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0 angle types
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0 dihedral types
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0 improper types
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0.0 9.865 xlo xhi
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0.0 9.865 ylo yhi
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0.0 9.865 zlo zhi
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Masses
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1 15.9994
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2 1.008
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Pair Coeffs
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1 0.102 3.188
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2 0.000 0.000
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Atoms
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1 0 1 0.00000 4.890520 4.325756 3.842052
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2 0 2 0.00000 3.893761 4.308535 3.950637
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3 0 2 0.00000 4.946166 4.514250 2.851741
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