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/ > > > * * * D I S C L A I M E R * * * > 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. > Mayuri Bora INSPIRE Fellow Advanced Functional Material Laboratory Tezpur University Napaam http://www.tezu.ernet.in/afml/ * * * D I S C L A I M E R * * * 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. _______________________________________________ Quantum ESPRESSO is supported by MaX (www.max-centre.eu) users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
