[Wien] WIen2k install using Oneapi

[Peter Blaha]

Seems to be a problem with the most recent ONEAPI. The include path for 
the compiler should be automatically set properly when you source the 
compilervars.sh files.

Try to define an additional include path:

   O   Compiler options:        -O -FR -mpl -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback -assume buffered_io -I$(MKLROOT)/include -I$(IFORTROOT)/linux/compiler/include/intel64


Please check, if in your oneapi the IFORTROOT variable is set and the 
filestructure is still identical to mine.

I do have a   omp_lib.mod   in the include path.



Am 27.05.2024 um 20:19 schrieb 夏宇阳:
> mstar.f90(57): error #7002: Error in opening the compiled module file.  Check INCLUDE paths.   [OMP_LIB]
> USE OMP_LIB
> ----^
>
> sumpara.F(4): error #7002: Error in opening the compiled module file.  Check INCLUDE paths.   [OMP_LIB]
>        use omp_lib
> ----------^
> sumpara.F(407): error #6363: The intrinsic data types of the arguments must be the same.   [MAX]
>        BUFSIZE=MAX(NKKVL/OMP_GET_NUM_THREADS()+1, 1000)
> -------------------------------------------------^
> Three errors still exists in compile.msg.
>
> It seems that we need omp_lib.module. What is that? And how can we get it?
>
> Best wishes!
> -- 

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Peter Blaha,  Inst. f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-158801165300
Email: peter.blaha at tuwien.ac.at
WWW:   http://www.imc.tuwien.ac.at      WIEN2k: http://www.wien2k.at
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