potfit wiki

open source force-matching

User Tools

Site Tools

output:lammps

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revisionPrevious revision
output:lammps [2019/04/19 09:11] – danieloutput:lammps [2019/08/11 12:04] (current) – daniel
Line 16: Line 16:
  
 e.g. ''MgZn.lammps.EAM'' for a Mg-Zn eam potential. e.g. ''MgZn.lammps.EAM'' for a Mg-Zn eam potential.
 +
 +You also need to provide ''lammpspotsteps'' in the parameter file. The value gives the number of sampling 
 +points used per potential when writing the tabulated LAMMPS potential file.
  
 ---- ----
output/lammps.1555657873.txt.gz · Last modified: 2019/04/19 09:11 by daniel