Unverified Commit be4704f8 authored by markuskowa's avatar markuskowa Committed by GitHub
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Merge pull request #263807 from sheepforce/cp2k 

cp2k: allow fortran argument mismatches
parents ff61a747 bde9b25c

pkgs/applications/science/chemistry/cp2k/default.nix

+2 −1
Original line number Diff line number Diff line
@@ -146,7 +146,8 @@ stdenv.mkDerivation rec { 
                 -fopenmp -ftree-vectorize -funroll-loops \

                 -I${lib.getDev libint}/include ${lib.optionalString enableElpa "$(pkg-config --variable=fcflags elpa)"} \

                 -I${lib.getDev sirius}/include/sirius \

                 -I${lib.getDev libxc}/include -I${lib.getDev libxsmm}/include

                 -I${lib.getDev libxc}/include -I${lib.getDev libxsmm}/include \

                 -fallow-argument-mismatch

    LIBS       = -lfftw3 -lfftw3_threads \

                 -lscalapack -lblas -llapack \

                 -lxcf03 -lxc -lxsmmf -lxsmm -lsymspg \