Hi
I have been trying to do a spin polarized calculation with HSE
(ISPIN =2) of a certain system and am getting an error message which looks as follows :
EDWAV: internal error, the gradient is not orthogonal 1
Can somebody please help ?
Thanks.
Chandrima
spin polarised calculation with HSE
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chandrima
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spin polarised calculation with HSE
Last edited by chandrima on Tue Apr 19, 2011 2:13 am, edited 1 time in total.
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support_vasp
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Re: spin polarised calculation with HSE
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.
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