[Wien] Ghostbands
Stefaan Cottenier
Stefaan.Cottenier at fys.kuleuven.be
Wed May 11 17:09:43 CEST 2005
>Is there any problems with Ghostbands in newer Versions of Wien2k that
did not
>take place in older Versions ? I was calculating for Pt but lapw2
stopped with an
>error message:'l2main' - QTL-B.GT.7., Ghostbands, check scf files. I
am wondering
>as I did the same calculation 1/2 year ago without any error ?
The newest version is just a bit more suspicious about using appropriate
linearization energies. Check the FAQ
http://www.wien2k.at/reg_user/faq/qtlb.html
Stefaan
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