[Wien] WIEN2k and gfortran II

John Rundgren jru at kth.se
Thu Dec 8 13:51:18 CET 2016


Dear Arthur,

"Linker Flags" and "R_LIB" are found by consulting google on "xianyi-openblas user manual".

The "include" flag is necessary, otherwise there is a conflict with /usr/link/ld.

Xianyi recommends -lopenblas and adds -lpthread -lgfortran with motivations understood by wise Linuxers. They have not done any harm.

Could you improve calculation time ...? In a previous wien-bounces you find a test where gfortran+openblas is fully competitive with intel+mkl. A try is worthwhile.

Best regards / John



John Rundgren
Department of Theoretical Physics, KTH Royal Institute of Technology
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