Dear LAMMPS users,
I am using "compute rdf" & "compute ave/time" in my rerun to compute rdf. In my original run I have dumped coordinates for every 2000 time steps in DCD format using dump dcd and using following lines in my rerun input script to compute rdf
compute 2 all rdf 200 1 1
fix 2 all ave/time 2000 1 2000 c_2 file rdf.lammps mode vector
with these lines job is running fine but not writing anything in the output file other than header lines. I know that problem is in choosing Nevery, Nrepat & Nfreq parameters. I have tried with other options like 2000 2 4000 but in vain.
can anybody help me in this regard.