[Wien] Verifying if the ghostbands still exists or not (no error received).

[Pranjal Nandi]

Dear Community,

Hello.

I was getting ghostbands error (version 21.1), so I changed the energy levels as per the various past online threads and guidelines.

After changing the energy levels, I DID NOT receive any errors and the calculations ran fine. However in the scf1, I see that in many cases E(TOP) = -200. In my calculations of other samples, when I changed the energy levels after getting ghostbands error, the E(TOP) value also changed.

Hence, I am worried if the results in this case are reliable or not? How can I be sure that there are no ghostbands now (does no error = no ghostbands?)

Requesting your kind guidance on the same.

Regards,
Pranjal


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