[QE-users] pw2wannier90 issue
Mayuri Bora
mayu219 at tezu.ernet.in
Tue Jun 1 11:49:49 CEST 2021
I am still waiting for the reply.
Thank You
> Dear QE user
>
> I am trying to interface wannier and QE with pw2wannier90.x. I am getting
> continuous error in direct lattice mismatch. The output as shown below-
>
> Spin CASE ( non-collinear )
>
> Wannier mode is: standalone
>
> -----------------
> *** Reading nnkp
> -----------------
>
> Checking info from wannier.nnkp file
>
> Something wrong!
> rlatt(i,j) = 8.335061334110377E-002 at(i,j)= 1.00000000000000
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> Error in routine pw2wannier90 (4):
> Direct lattice mismatch
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
> stopping ...
>
> I will be thankful if i get some help in this regard.
>
> regards
> Mayuri
>
>
> Mayuri Bora
> INSPIRE Fellow
> Advanced Functional Material Laboratory
> Tezpur University
> Napaam
> http://www.tezu.ernet.in/afml/
>
>
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Mayuri Bora
INSPIRE Fellow
Advanced Functional Material Laboratory
Tezpur University
Napaam
http://www.tezu.ernet.in/afml/
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This e-mail may contain privileged information and is intended solely for the individual named. If you are not the named addressee you should not disseminate, distribute or copy this e-mail. Please notify the sender immediately by e-mail if you have received this e-mail in error and destroy it from your system. Though considerable effort has been made to deliver error free e-mail messages but it can not be guaranteed to be secure or error-free as information could be intercepted, corrupted, lost, destroyed, delayed, or may contain viruses. The recipient must verify the integrity of this e-mail message.
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