{ 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 ]; }; }