48 lines
1.5 KiB
Ruby
48 lines
1.5 KiB
Ruby
class Libxc < Formula
|
|
desc "Library of exchange and correlation functionals for codes"
|
|
homepage "http://www.tddft.org/programs/libxc/"
|
|
url "http://www.tddft.org/programs/octopus/download/libxc/4.2.3/libxc-4.2.3.tar.gz"
|
|
sha256 "02e49e9ba7d21d18df17e9e57eae861e6ce05e65e966e1e832475aa09e344256"
|
|
|
|
bottle do
|
|
cellar :any
|
|
sha256 "d3cae48aff1879bd255e227fd5a305f5bfc537ad9e3b5709e09b434e4a43dffa" => :mojave
|
|
sha256 "57b6d9d003ad48a50b571722e9fa59a3786f43fe90eab310ce75526c207c4b4f" => :high_sierra
|
|
sha256 "ae70a828ecc3c097f6bc74660bbb60618be640b3c0f80db6c5fce0ea129c0c8c" => :sierra
|
|
end
|
|
|
|
depends_on "gcc" # for gfortran
|
|
|
|
def install
|
|
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, µ);
|
|
printf(\"%d.%d.%d\", major, minor, micro);
|
|
}
|
|
EOS
|
|
system ENV.cc, "test.c", "-L#{lib}", "-lxc", "-I#{include}", "-o", "ctest"
|
|
system "./ctest"
|
|
|
|
(testpath/"test.f90").write <<~EOS
|
|
program lxctest
|
|
use xc_f90_types_m
|
|
use xc_f90_lib_m
|
|
end program lxctest
|
|
EOS
|
|
system "gfortran", "test.f90", "-L#{lib}", "-lxc", "-I#{include}",
|
|
"-o", "ftest"
|
|
system "./ftest"
|
|
end
|
|
end
|