[Wien] Strange lapw1 problem
Björn Hülsen
huelsen at fhi-berlin.mpg.de
Thu Jul 28 11:19:04 CEST 2005
The only thing I changed in the case.in1 files is the value for R-MT *
K-max. So all the files look the same (besides the different number of
atoms). I will change the linearization for the 12 layers slab but I
don't see why it should work for all other layers and not for this one.
To L.D. Marks: I don't understand your N.B.
--
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Björn Hülsen Phone: (+49 30) 8413-4863
Fritz-Haber-Institut
Faradayweg 4-6 WWW: www.fhi-berlin.mpg.de
D-14195 Berlin (Germany) E-Mail: huelsen at fhi-berlin.mpg.de
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