how to compute RDF in lammps?

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1

Dear all,
I want to compute RDF for longer cutoff pair style. but i can not do it. how to compute RDF in lammps?

thanks a lot.

mousavi

2

Dear all,
I want to compute RDF for longer cutoff pair style. but i can not do it.
how to compute RDF in lammps?

3

Note that if you want to calculate it for a cut-off larger than the one you used for your simulation, you can extract it in post-processing with the rerun and dump commands.

4

Note that if you want to calculate it for a cut-off larger than the one
you used for your simulation, you can extract it in post-processing with
the rerun and dump commands.

Please note, that ​as of ​version 21 Feb 2017 compute rdf can set its own
cutoff and request a custom neighbor list with a cutoff different from the
cutoff used for the pair style.

axel.

5

Oh, nice, I missed that! :slight_smile: