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authorAssassinkin <iuns@outlook.fr>2018-07-11 18:28:05 +0100
committerAssassinkin <iuns@outlook.fr>2018-08-01 10:58:23 +0100
commit6ee997a5ff77ded82777ffd46b558e0719da4b38 (patch)
tree5967d512aeade847863de02ca7ce48014544049f
parent791d50fd3fd27c8f5dc0e8c02811fcf199c7b2c9 (diff)
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pythonPackages.sumo:init at 1.0.9
-rw-r--r--pkgs/development/python-modules/sumo/default.nix24
-rw-r--r--pkgs/top-level/python-packages.nix2
2 files changed, 26 insertions, 0 deletions
diff --git a/pkgs/development/python-modules/sumo/default.nix b/pkgs/development/python-modules/sumo/default.nix
new file mode 100644
index 00000000000..1b82f1a4010
--- /dev/null
+++ b/pkgs/development/python-modules/sumo/default.nix
@@ -0,0 +1,24 @@
+{ stdenv, buildPythonPackage, fetchFromGitHub, numpy, scipy, spglib, pymatgen, h5py, matplotlib, seekpath, phonopy }:
+
+buildPythonPackage rec {
+  pname = "sumo";
+  version = "1.0.9";
+
+  # No tests in Pypi tarball
+  src = fetchFromGitHub {
+    owner = "SMTG-UCL";
+    repo = "sumo";
+    rev = "v${version}";
+    sha256 = "1zw86qp9ycw2k0anw6pzvwgd3zds0z2cwy0s663zhiv9mnb5hx1n";
+  };
+
+  propagatedBuildInputs = [ numpy scipy spglib pymatgen h5py matplotlib seekpath phonopy ];
+  
+  meta = with stdenv.lib; {
+    description = "Toolkit for plotting and analysis of ab initio solid-state calculation data";
+    homepage = https://github.com/SMTG-UCL/sumo;
+    license = licenses.mit;
+    maintainers = with maintainers; [ psyanticy ];
+  };
+}
+
diff --git a/pkgs/top-level/python-packages.nix b/pkgs/top-level/python-packages.nix
index 96203d95db3..b17ba083a14 100644
--- a/pkgs/top-level/python-packages.nix
+++ b/pkgs/top-level/python-packages.nix
@@ -503,6 +503,8 @@ in {
 
   spglib = callPackage ../development/python-modules/spglib { };
 
+  sumo = callPackage ../development/python-modules/sumo { };
+
   supervise_api = callPackage ../development/python-modules/supervise_api { };
 
   syncserver = callPackage ../development/python-modules/syncserver {};