47 lines
1.1 KiB
Plaintext
47 lines
1.1 KiB
Plaintext
"LAMMPS WWW Site"_lws - "LAMMPS Documentation"_ld - "LAMMPS Commands"_lc :c
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:link(lws,http://lammps.sandia.gov)
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:link(ld,Manual.html)
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:link(lc,Section_commands.html#comm)
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:line
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write_coeff command :h3
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[Syntax:]
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write_coeff file :pre
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file = name of data file to write out :pre
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[Examples:]
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write_coeff polymer.coeff :pre
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[Description:]
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Write a text format file with the currently defined force field
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coefficients in a way, that it can be read by LAMMPS with the
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"include"_include.html command. In combination with the nocoeff
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option of "write_data"_write_data.html this can be used to move
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the Coeffs sections from a data file into a separate file.
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NOTE: The write_coeff command is not yet fully implemented in two
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respects. First, some pair styles do not yet write their coefficient
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information into the coeff file. This means you will need to specify
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that information in your input script that reads the data file, via
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the "pair_coeff"_pair_coeff.html command.
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:line
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[Restrictions:]
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none
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[Related commands:]
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"read_data"_read_data.html, "write_restart"_write_restart.html,
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"write_data"_write_data.html
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