HI everybody, I am new to lammps and trying to finish a project with lammps-10May10 version.
The structure file I used was converted from Materials Studio via msi2lmp. I’ve already checked the file content to change Dihedral coef and Improper coef to integer but this error still showed up. Could anyone help me out? I’ve tried an older version of lammps on my laptop but it works just fine with this structure file.
Here are a sample of part of my structure file.
Pair Coeffs
1 0.1479999981 3.6170487995
2 0.0380000011 2.4499714540
3 0.0389999952 3.8754094636
…
Bond Coeffs
1 480.0000 1.3400
2 283.0924 1.5100
3 363.4164 1.0800
…
Angle Coeffs
1 90.0000 120.0000
2 44.2000 120.0000
3 37.0000 120.0000
…
Dihedral Coeffs
1 3 -1 2
2 3 -1 2
3 3 -1 2
4 3 -1 2
5 0 1 2
6 0 1 2
7 0 1 2
8 3 -1 2
9 0.1581 1 3
10 0.1581 1 3
11 0.1581 1 3
…
Improper Coeffs
1 0.3700 -1 2
2 0.3700 -1 2
3 11.6000 -1 2
4 11.6000 -1 2
Thank you all!