2009/6/18 Paolo Giannozzi <giannozz at democritos.it>
>
> On Jun 18, 2009, at 14:28 , ?? wrote:
>
> > celldm(1)=2.4434,
>
> these are a.u., not A
>
Dear Paolo,
Thanks for your respond, I have checked the units and I change the input
to "celldm(1)=4.6189", but the band structure still seems wrong.
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