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RDF Generation Issue — Output Contains -nan / -inf Values #54

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@rayanamanoj98

Hi,

I attempted to generate RDF files using the provided script/workflow. The files were generated, but the final values in each file are -nan and -inf. I have attached:

  • A sample RDF file that shows the issue
  • The simulation input file that produced it

Could you please check and advise what might be causing this behavior?

rdf_C1_S_S.s0.txt
rdf_Li16_S_S.s0.txt
rdf_N1_S_S.s0.txt

simulation.json

Thanks in advance!

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