[Wien] optic problem : case.mme file lost

Peter Blaha pblaha at theochem.tuwien.ac.at
Mon Feb 20 14:37:04 CET 2006


>    I am calculating the optic property. I followed the UG and got to
> 
> x optic -so -up -p 
> 
> but the there were some messages:

> cat: ./sinc.mme_1up: No such file or directory

There is a small bug in   opticpara_lapw   for spinpolarized cases:

Search for the line:
s/mme$updn/&_$i/w .mist

and replace it by:
s/mme/&_$i/w .mist

It will be fixed in the next update


                                      P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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