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[flokno]

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[ganesh028]

Hello Flokno,
I am wondering how I could get rid of this symmetry error.

Best regards,
Dr. Ganesh K Nayak

... reading unitcell
... min cutoff: 2.68274
... max cutoff: 5.60156

DETERMINING SYMMETRY OF INTERACTION TENSORS
... constructed distance tables (0.01014s)
... built singlets
... built pairs
... built prototype tuplets (0.00019s)
... expanded symmetry operations (0.10744s)
... reducing pairs 100.0% |========================================| 0.00046s

ERROR
exit code 4: symmetry error

Could not locate tuplet

 occurs in file: lo_symmetry_of_interactions_tuplets.f90
 occurs on line: 730
    active rank: 0 out of 1

[flokno]

Hi @ganesh028 👋 , can you open an issue and include your input files there?

[ganesh028]

Thanks, Flikno, I just did. Thank you in advance!