[Wannier] write out the matrix elements using pw2wannier90.f90

[jiaxu yan]

Hi Giovanni Pizzi

My version was 5.0.99. Now I adopt the SVN version and everything goes
well. Thanks for your help.
The obtained uHu file seems complex...

Another question: How to get the k-space H(k) in Wannier functions basis
instead of the real space Hamiltonian H(R)
given in case _hr.dat? I have searched in the forum and found wannier_ham.x
may be useful. Unfortunately, the available
example (PP/examples/WannierHam_example) runs well, but my graphene case
fails.

*%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%*
*Error in routine wannier_proj (1):     wrong orthogonalization on k-point *


*%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%*Anyone know about
it? All related files are attached...

Wayne, Yan
Division of Physics and Applied Physics
School of Physical and Mathematical Sciences
Nanyang Technological University, Singapore
yanjiaxu at gmail.com
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