21 lines
401 B
Plaintext
21 lines
401 B
Plaintext
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units metal
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atom_style atomic
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boundary p p p
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read_data data.fe
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pair_style meam
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pair_coeff * * FeTiClibrary.meam Fe Ti C FeTiC.meam C Fe
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thermo 10
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thermo_style custom step pe etotal fmax fnorm temp press
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thermo_modify format 4*6 %14.10f
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#dump equilibration all custom 1 dump.equilibration id type xu yu zu #v_Adam_m
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min_style fire
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minimize 0 1e-8 2000 2000
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