Hi:
How should I save or print the information for the last step, if I dump every 1000 steps? Thanks. I checked the LAMMPS manual and did not find any relevant options.
Best
Jun
Hi:
How should I save or print the information for the last step, if I dump every 1000 steps? Thanks. I checked the LAMMPS manual and did not find any relevant options.
Best
Jun
You can write a data file at the end of the simulation, or
If you are running a simulation with n + remainder steps, where n is divisible by 1000, and want to dump the final configuration:
dump myDump all atom 1000 dump.atoms
run n
dump myDump2 all atom remainder dump2.atoms
run remainder
This is perfectly fine. All your fixes will remain active, and the final configuration (and the nth configuration) will be stored in dump2.atoms, which you can concatenate to dump.atoms.
-Keith
please check out the “write_dump” command to write a single frame dump file at (nearly) any time.
axel.