Add 'nixpkgs/' from commit '2436c27541b2f52deea3a4c1691216a02152e729'

git-subtree-dir: nixpkgs
git-subtree-mainline: 1148b1d122bc03e9a3665856c9b7bb96bd4e3994
git-subtree-split: 2436c27541b2f52deea3a4c1691216a02152e729

1 files changed, 30 insertions, 0 deletions

diff --git a/nixpkgs/pkgs/development/python-modules/pymatgen-lammps/default.nix b/nixpkgs/pkgs/development/python-modules/pymatgen-lammps/default.nix
new file mode 100644
index 00000000000..c38f56885d1
--- /dev/null
+++ b/nixpkgs/pkgs/development/python-modules/pymatgen-lammps/default.nix
@@ -0,0 +1,30 @@
+{ lib
+, fetchurl
+, buildPythonPackage
+, pymatgen
+, pytestrunner
+, pytest
+, isPy3k
+}:
+
+buildPythonPackage rec {
+  pname = "pymatgen-lammps";
+  version = "0.4.5";
+  disabled = (!isPy3k);
+
+  src = fetchurl {
+     url = "https://gitlab.com/costrouc/${pname}/-/archive/v${version}/${pname}-v${version}.tar.gz";
+     sha256 = "0shldl8is3195jmji7dr3zsh1bzxlahaqrmpr28niks7nnfj80fx";
+  };
+
+  buildInputs = [ pytestrunner ];
+  checkInputs = [ pytest ];
+  propagatedBuildInputs = [ pymatgen ];
+
+  meta = {
+    description = "A LAMMPS wrapper using pymatgen";
+    homepage = https://gitlab.com/costrouc/pymatgen-lammps;
+    license = lib.licenses.mit;
+    maintainers = with lib.maintainers; [ costrouc ];
+  };
+}