*
Should I use the|spin_component|keyword to specify up-spin or
down-spin bands, or is it recommended to simply
run|bands.x|without this keyword?
It depends on what you want to achieve.
*
I tried using|spin_component=1|and|2|, but I encountered errors in
both cases. On the other hand, when I ran|bands.x|without
the|spin_component|keyword, the job completed normally.
Which error?
Could you please advise on the correct way to handle this situation?
Any guidance or clarification would be greatly appreciated.
The correct way is to provide the full input and output of the
calculation that is giving you trouble. And, more in general, if you
think that a specific output is wrong, you should explain why you think so.
kind regards
Thank you in advance for your help.
Best regards,
Rameswar Bhattacharjee
--
Rameswar Bhattacharjee
Georgetown University
Washington, DC 20057
_______________________________________________________________________________
The Quantum ESPRESSO Foundation stands in solidarity with all civilians
worldwide who are victims of terrorism, military aggression, and indiscriminate
warfare.
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--
Dr. Lorenzo Paulatto
IR IMPMC - CNRS UMR 7590 / Sorbonne Université / MNHN
phone: +33 (0)1 442 79822 / telegram: lpaulatto
http://www.impmc.upmc.fr/~paulatto/ - https://anharmonic.github.io/
23-24/423 B115, 4 place Jussieu 75252 Paris CX 05
_______________________________________________________________________________
The Quantum ESPRESSO Foundation stands in solidarity with all civilians
worldwide who are victims of terrorism, military aggression, and indiscriminate
warfare.
--------------------------------------------------------------------------------
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list [email protected]
https://lists.quantum-espresso.org/mailman/listinfo/users
