|From:||Tim Lodewyckx <timlodewyckx@...8...>|
|Date:||Thu, 12 Apr 2018 09:00:16 +0000|
Dear LAMMPS users,
Is it possible that the write_coeff command does not write bond coefficients if bond_style hybrid is used? I checked it and I can print any bond coefficient if I restrict myself to a single bond type:
bond_coeff bondID K r0
bond_coeff bondID D alpha r0
If I use the same bond coefficients, but this time with bond_style hybrid, it doesn't print any bond coefficients.
bond_style hybrid harmonic morse
bond_coeff bondID harmonic K r0
bond_coeff bondID morse D alpha r0
Does it mean these coefficients are zero when I use bond_style hybrid or are they just not written down by the write_coeff command?