[QE-users] [vc-relax and ion-convergence(3) error]

박기명 knppkm at naver.com
Mon Mar 10 10:24:52 CET 2025


I have a question about the ion convergence problem. When performing vc-relax, all calculations are finished and the ion convergence issue occurs as shown below.
How could I solve this error?


     Parallel routines

     PWSCF        :      1h22m CPU      1h27m WALL


   This run was terminated on:  20: 9:29   9Mar2025

=------------------------------------------------------------------------------=
   JOB DONE.
=------------------------------------------------------------------------------=
3
3
3
3
3
3
3
3
3
3
3
3
3
3
3
3
3
3
3
3

Thank you

Sincerely,
Gimyung Park
Yonsei University


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