Update USER_QUIP docs to clarify use of "special_bonds"
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@ -80,6 +80,14 @@ LAMMPS"_Section_start.html#start_3 section for more info.
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QUIP potentials are parametrized in electron-volts and Angstroms and
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therefore should be used with LAMMPS metal "units"_units.html.
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QUIP potentials are generally not designed to work with the scaling
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factors set by the "special_bonds"_special_bonds.html command. The
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recommended setting in molecular systems is to include all
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interactions, i.e. to use {special_bonds lj 1.0 1.0 1.0}. The only
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exception to this rule is if you know that your QUIP potential needs
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to exclude bonded, 1-3, or 1-4 interactions and does not already do
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this exclusion within QUIP.
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[Related commands:]
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"pair_coeff"_pair_coeff.html
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