nixpkgs-suyu/pkgs/development/python-modules/phonopy/default.nix
2018-08-01 10:57:14 +01:00

27 lines
722 B
Nix

{ stdenv, buildPythonPackage, python, fetchPypi, numpy, pyyaml, matplotlib, h5py }:
buildPythonPackage rec {
pname = "phonopy";
version = "1.13.2.13";
src = fetchPypi {
inherit pname version;
sha256 = "23970ecdf698e743f9204711e8edfbb33c97667f5f88c7bda3322abbc91d0682";
};
propagatedBuildInputs = [ numpy pyyaml matplotlib h5py ];
checkPhase = ''
cd test/phonopy
${python.interpreter} -m unittest discover -b
cd ../..
'';
meta = with stdenv.lib; {
description = "A package for phonon calculations at harmonic and quasi-harmonic levels";
homepage = https://atztogo.github.io/phonopy/;
license = licenses.bsd0;
maintainers = with maintainers; [ psyanticy ];
};
}