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Merge pull request #263807 from sheepforce/cp2k

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cp2k: allow fortran argument mismatches
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markuskowa 2023-10-27 20:56:20 +02:00 committed by GitHub
commit be4704f84a
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1 changed files with 2 additions and 1 deletions
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pkgs/applications/science/chemistry/cp2k/default.nix
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@ -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 \