{ stdenv , lib , fetchFromGitLab , gfortran , autoreconfHook , fftwMpi , mpi }: stdenv.mkDerivation rec { pname = "libvdwxc"; # Stable version has non-working MPI detection. version = "unstable-24.02.2020"; src = fetchFromGitLab { owner = "libvdwxc"; repo = pname; rev = "92f4910c6ac88e111db2fb3a518089d0510c53b0"; sha256 = "1c7pjrvifncbdyngs2bv185imxbcbq64nka8gshhp8n2ns6fids6"; }; nativeBuildInputs = [ autoreconfHook gfortran ]; buildInputs = [ mpi fftwMpi ]; preConfigure = '' mkdir build && cd build export PATH=$PATH:${mpi}/bin configureFlagsArray+=( --with-mpi=${lib.getDev mpi} CC=mpicc FC=mpif90 MPICC=mpicc MPIFC=mpif90 ) ''; configureScript = "../configure"; hardeningDisable = [ "format" ]; doCheck = true; meta = with lib; { description = "Portable C library of density functionals with van der Waals interactions for density functional theory"; license = with licenses; [ lgpl3Plus bsd3 ]; homepage = "https://libvdwxc.org/"; platforms = platforms.unix; maintainers = [ maintainers.sheepforce ]; }; }