[Wien] problem in compiling mstar with gfortran

Jerzy Goraus jerzy.goraus at smcebi.edu.pl
Fri Jan 27 11:43:05 CET 2023


Dear All,

I noticed, that in recent verions of Linux Mint (>20) and Ubuntu there are

mkl libs  in their repositories (see apt search mkl) and are perfectly 
usable with gfortran, and are

faster and less problematic than openblas,

sincerely

Jerzy Goraus


On 27.01.2023 10:07, Peter Blaha wrote:
> The missing routine is part of blas/lapack libraries.
>
> I very much doubt that you can link mkl routines with gfortran, at 
> least it does not make sense (if you have the mkl, you should also 
> have ifort).
>
> Instead you should link with the same library what you used for 
> lapw1,....
> It should be an openblas library which comes with your linux.
>
> PS: It seems you did not use the WIEN2k version (SRC_mstar) with 
> siteconfig but downloaded the github version and modified the Makefile 
> by hand ? You also need to adopt the FLFLAGS.
>
>


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