forked from lijiext/lammps
21 lines
407 B
Plaintext
21 lines
407 B
Plaintext
# DATE: 2019-09-18 UNITS: metal CONTRIBUTOR: Mary Alice Cusentino mcusent@sandia.gov CITATION: M.A. Wood, M.A. Cusentino, B.D. Wirth, and A.P. Thompson, "Data-driven material models for atomistic simulation", Physical Review B 99, 184305 (2019)
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# required
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rcutfac 4.8123
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twojmax 8
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# elements
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nelems 2
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elems W Be
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radelems 0.5 0.417932
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welems 1 0.959049
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# optional
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rfac0 0.99363
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rmin0 0
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bzeroflag 1
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