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{ lib, stdenv, fetchFromGitLab, cmake, gfortran, perl }:
stdenv.mkDerivation rec {
pname = "libxc";
version = "5.1.6";
src = fetchFromGitLab {
owner = "libxc";
repo = "libxc";
rev = version;
sha256 = "07iljmv737kx24kd33x9ndf5l854mwslg9x2psqm12k07jmq9wjw";
};
nativeBuildInputs = [ perl cmake gfortran ];
preConfigure = ''
patchShebangs ./
'';
cmakeFlags = [ "-DENABLE_FORTRAN=ON" "-DBUILD_SHARED_LIBS=ON" ];
preCheck = ''
export LD_LIBRARY_PATH=$(pwd)
'';
doCheck = true;
meta = with lib; {
description = "Library of exchange-correlation functionals for density-functional theory";
homepage = "https://www.tddft.org/programs/Libxc/";
license = licenses.mpl20;
platforms = [ "x86_64-linux" ];
maintainers = with maintainers; [ markuskowa ];
};
}
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