[QE-users] Error in routine memory_report (1): more bands than PWs!

Paolo Giannozzi paolo.giannozzi at uniud.it
Thu May 16 19:35:37 CEST 2024


You have forgotten to set the correct lattice parameter somewhere: your 
structure is extremely dense

Paolo
On 15/05/2024 12:13, Максим Арсентьев wrote:
> Dear users and developers,
> After running carbon allotrope relaxation I got this error:
> Error in routine memory_report (1): more bands than PWs!
> Best regards,
> Dr. Maxim Arsentev
> Research Fellow of Infochemistry Scientific Center (ISC)
> ITMO University
> 
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-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine Italy, +39-0432-558216
AVAILABLE POSITION: 
https://physicslab.uniud.it/persone/paolo-giannozzi/prin2022


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