[Wien] Wien2k

Peter Blaha pblaha at theochem.tuwien.ac.at
Tue Feb 22 09:32:15 CET 2011


>   I am using Wien2k_10.0. I compiled this in my machines ubuntu 9.04
> using gfortran compiler. After compilation I am not getting error in
> compile.msg. But when i am running 'x tetra' for DOS i am getting
> following error
>
> Segmentation fault

I think a similar report + fix was discussed in the mailing list. Search for it.


> and for MBJ( modified Becke John potential) I am getting this error
>
> STOP  LAPW0 END
> At line 1653 of file lapw0.F (unit = 11, file = 'CsCaF3.r2v')
> Fortran runtime error: Constant string in input format
> (1X,"        ",I10)
>               ^

Did you follow the instructions ?. Do you have a proper case.r2v file ?

-- 

                                       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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