[Wien] wave function

fatemeh.mirjani f_mirjani at ph.iut.ac.ir
Mon Feb 4 11:34:06 CET 2008


I want to explore the wannier function from a result obtained by wien2k.
I read mailing list and found that maybe LAPW7 is not suitable for exploring the wave function because it works with LAPW not APW+lo.I saw one person had said that with LAPW2 we can calculate coefficients that need for wave function.
but I couldn't found Alm,Blm,Clm coefficients with LAPW2 even when I put WFPRI into case.in1 .

what should I do?how?
Thanking you in advance for your help, 
fateme.mirjani


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