- removed version
RDF generates an artificial peak at approx 1
Issue #193
resolved
With some systems there is a large peak at about r=1. I've attached a minimal script and a representative .pos file that replicates this error.
Comments (3)
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reporter -
- changed version to 0.10
- marked as major
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assigned issue to
I am taking a look at this.
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- changed status to resolved
This is an issue in the original simulation data, not a problem with
freud
. A tabulated potential in HOOMD needs more data near small values of r, and it is artificially creating bound systems. (This is not a problem with HOOMD, just improper user input.) - Log in to comment