depot/third_party/nixpkgs/pkgs/development/python-modules/boltztrap2/default.nix
Default email a5adf1ddd8 Project import generated by Copybara.
GitOrigin-RevId: b3616bd96400ce0252c241d76fcafb64389defc6
2021-01-15 23:18:51 +01:00

45 lines
895 B
Nix

{ lib, stdenv
, buildPythonPackage
, fetchPypi
, spglib
, numpy
, scipy
, matplotlib
, ase
, netcdf4
, pytest
, pythonOlder
, cython
, cmake
}:
buildPythonPackage rec {
version = "20.7.1";
pname = "BoltzTraP2";
disabled = pythonOlder "3.5";
src = fetchPypi {
inherit pname version;
sha256 = "41caa32e5778323471d87033f23537f6178a7aea64fba894c7f2b2579b51f7ed";
};
dontUseCmakeConfigure = true;
nativeBuildInputs = [ cmake cython ];
checkInputs = [ pytest ];
propagatedBuildInputs = [ spglib numpy scipy matplotlib ase netcdf4 ];
# pypi release does no include files for tests
doCheck = false;
checkPhase = ''
py.test
'';
meta = with lib; {
homepage = "http://www.boltztrap.org/";
description = "Band-structure interpolator and transport coefficient calculator";
license = licenses.gpl3;
maintainers = [ maintainers.costrouc ];
};
}