[Pw_forum] Plot |psi|^2 for an arbitary k point

Tianshu Li tsli at ucdavis.edu
Wed Jul 12 21:49:02 CEST 2006


Dear PWSCF users and developers:

In running post-processing pp.x, I got an error message  "    from 
local_dos : error #         1
     k must be zero" when calculating |psi|^2 for a non-zero K point. 
I've searched the code "local_dos.F90" and find that the non-zero K 
point does not seem to be allowed. Since there is a "kpoint" keyword in 
the input list, I just wonder if the non-zero K point wavefunction 
visualization has not been implemented yet. Thanks

Tianshu Li




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