diff --git a/pkgs/development/python-modules/pyscf/default.nix b/pkgs/development/python-modules/pyscf/default.nix
index 8bf556ac0cba..f44ea70eee54 100644
--- a/pkgs/development/python-modules/pyscf/default.nix
+++ b/pkgs/development/python-modules/pyscf/default.nix
@@ -16,18 +16,18 @@
 
 buildPythonPackage rec {
   pname = "pyscf";
-  version = "2.5.0";
+  version = "2.6.0";
   format = "setuptools";
 
   src = fetchFromGitHub {
     owner = "pyscf";
     repo = pname;
     rev = "refs/tags/v${version}";
-    hash = "sha256-UCchzoYsqeIGViewPf4KedmhYktXLmp5Me4lzb1i8p0=";
+    hash = "sha256-y1RQKxFfhOC6+vUMJiXexaZeYZhav5t30XP7jooJ//0=";
   };
 
   # setup.py calls Cmake and passes the arguments in CMAKE_CONFIGURE_ARGS to cmake.
-  nativeBuildInputs = [ cmake ];
+  build-system = [ cmake ];
   dontUseCmakeConfigure = true;
   preConfigure = ''
     export CMAKE_CONFIGURE_ARGS="-DBUILD_LIBCINT=0 -DBUILD_LIBXC=0 -DBUILD_XCFUN=0"
@@ -41,7 +41,7 @@ buildPythonPackage rec {
     xcfun
   ];
 
-  propagatedBuildInputs = [
+  dependencies = [
     cppe
     h5py
     numpy