class2 bond

Dear Lammps users

I tried to define a class2 type angle potential and I defined it as

angle_coeff 1 104.0 195.5 48.9 185.1 #ao oh ao
angle_coeff 1 bb 20.94 2.035 2.035 #ao oh ao
angle_coeff 1 ba -1.328 -1.328 2.035 2.035 #ao oh ao

input file in.****. Is this the correct way of doing this


Milinda Samaraweera
Computational materials chemistry and Computer programming
University of Connecticut
Department of Chemistry
55 N Eagleville road
unit 3060
Storrs CT

Why not try it? The doc page has all
the details.