What is the best method to simulation of polymer in lammps?
How Can I build data file?
I want to simulate polymers with pcff force field.
I use msi2lmp,but it has many errors!
Thanks
What is the best method to simulation of polymer in lammps?
what kind of polymer?
what do you understand as "best"?
How Can I build data file?
there are many ways. the format is well documented.
there are several tools to generate one.
I want to simulate polymers with pcff force field.
well, that is your choice.
I use msi2lmp,but it has many errors!
so you have an incentive to fix it.
this is how these tools get written
and corrected.
axel.