20 lines
211 B
Plaintext
20 lines
211 B
Plaintext
# LAMMPS SNAP parameters for MLIAP compute example
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# required
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rcutfac 1.0
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twojmax 2
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# elements
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nelems 2
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elems A B
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radelems 2.3 2.0
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welems 1.0 0.96
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# optional
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rfac0 0.99363
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rmin0 0
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bzeroflag 0
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switchflag 0
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