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Enquiry about the WAVECAR and CHGCAR

Posted: Thu Nov 28, 2013 3:14 am
by kieran
Dear all,

May I make an enquiry?

I set LWAVE and LCHARG as .TRUE. in INCAR file; however, I found that WAVECAR and CHGCAR file were written only after the calculation was finished. What if I encounter the power-shut-down or server-reboot and the calculation is not done at that moment? The WAVECAR and CHGCAR file would be empty and I would not be able to re-start the calculation by using the previous wave function and charge density. Is there any way to sort out this problem?

Any question would be appreciated.

Yours Sincerely,

Kieran

Re: Enquiry about the WAVECAR and CHGCAR

Posted: Tue Sep 10, 2024 2:37 pm
by support_vasp

Hi,

We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.

Best wishes,

VASP