[Pw_forum] kohn -sham orbitals ortogonality and ortonormality

[naz...@iasbs.ac.ir]

>> Would you please let me know how the
S|psi> is obtained with pp.x 
> 
> you need to modify
the code?
???
??? Which part
of the code. Would you please let me know the? name of files
that? should be? changed?


>> I need
orthonormal kohn-sham orbitals. 
> 
> in order to do
what??
??? I wish to??find the
localized orbitals.

Regards
Fariba Nazari
IASBS

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