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Warning: "chargedensity file is incomplete"

Posted: Fri Sep 01, 2023 12:53 pm
by xiaolei_liu
I am calculating DOS and band structure of CdTe. I had done self consistency calculation before I did DOS and band structure. But I got a warning "chargedensity file is incomplete" when the CHGCAR was read. The CHGCAR file was obtained in the self consistency calculation. In general, do you know what causes this warning?

Re: Warning: "chargedensity file is incomplete"

Posted: Fri Sep 01, 2023 4:07 pm
by xiaolei_liu
I have changed the LCHARG setting from FALSE to TRUE during the self consistency calculation. After that, I do not get the warning.

Re: Warning: "chargedensity file is incomplete"

Posted: Sun Sep 03, 2023 4:30 pm
by ferenc_karsai
Thank you for posting the solution!