homebrew-core/Formula/libxc.rb

56 lines
2.1 KiB
Ruby

class Libxc < Formula
desc "Library of exchange and correlation functionals for codes"
homepage "https://tddft.org/programs/libxc/"
url "https://gitlab.com/libxc/libxc/-/archive/5.2.3/libxc-5.2.3.tar.bz2"
sha256 "6cd45669d7f92bdcdb6879bea232dac94ad57d025cf2edfd019182ccf6494a75"
license "MPL-2.0"
revision 1
bottle do
sha256 cellar: :any, arm64_monterey: "76984fead2d7c7162093695d21d7c5b5966087b60a84e9995480851cc742d002"
sha256 cellar: :any, arm64_big_sur: "6667ca67895897ca00340ecc4164449483f46e226affae45a70ca62f1f7d8a7c"
sha256 cellar: :any, monterey: "baabce501ca109c134573955355b005279a151e01d3dc93ad60f0d0ac8ffe104"
sha256 cellar: :any, big_sur: "e2a9c845aef36fe679b3694cd8aa3b446b37ceec17bfaee76d5412881e61dd39"
sha256 cellar: :any, catalina: "d0ce63f9d4f79cd42bb34b5cf53b535d96adbf527d2865c3b8b0ad52278e3249"
sha256 cellar: :any_skip_relocation, x86_64_linux: "e08ca5a0e6a6976022c59789c27052b16b5d44cc4eab0fe3f0fa295fcee57e20"
end
depends_on "autoconf" => :build
depends_on "automake" => :build
depends_on "libtool" => :build
depends_on "gcc" # for gfortran
def install
system "autoreconf", "-fiv"
system "./configure", "--prefix=#{prefix}",
"--enable-shared",
"FCCPP=gfortran -E -x c",
"CC=#{ENV.cc}"
system "make", "install"
end
test do
(testpath/"test.c").write <<~EOS
#include <stdio.h>
#include <xc.h>
int main()
{
int major, minor, micro;
xc_version(&major, &minor, &micro);
printf(\"%d.%d.%d\", major, minor, micro);
}
EOS
system ENV.cc, "test.c", "-L#{lib}", "-I#{include}", "-lxc", "-o", "ctest", "-lm"
system "./ctest"
(testpath/"test.f90").write <<~EOS
program lxctest
use xc_f03_lib_m
end program lxctest
EOS
system "gfortran", "test.f90", "-L#{lib}", "-lxc", "-I#{include}",
"-o", "ftest"
system "./ftest"
end
end