[QE-users] problem in parallel exexution of example07 of HP
Mpayami
mpayami at aeoi.org.ir
Fri May 19 08:28:28 CEST 2023
Dear QE users,
Hi.
I am trying to run example07 of HP code in parallel. So, I prepared the relevant inputs and started to run simultaneously on different nodes each.
I get the meaage for all perturbed atoms and their corresponding q-points:
********
=--------------------------------------------=
START SOLVING THE LINEAR SYSTEM
=--------------------------------------------=
atom # 1 q point # 3 iter # 1
kpoint 1 hp_solve_linear_system: root not converged, thresh < 0.967E-07
Try to increase thresh_init...
************************
This behavior is not seen when running sequentially as does the "run_example".
Should I run any preparatory calculations before starting the parallel one?
Any comments is highly appreciated.
Bests,
Mahmoud
-------------------------------
Mahmoud Payami
NSTRI, AEOI,Tehran, Iran
Email: mpayami at aeoi.org.ir
Phone: +98(0)2182066504
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