From 4e013fb4ab7f4da8912614d7e887ecb0ef3c4e98 Mon Sep 17 00:00:00 2001
From: "R. Ryantm" <ryantm-bot@ryantm.com>
Date: Sat, 7 Feb 2026 05:57:17 +0000
Subject: [PATCH 1/2] python3Packages.pyscf: 2.12.0 -> 2.12.1

---
 pkgs/development/python-modules/pyscf/default.nix | 4 ++--
 1 file changed, 2 insertions(+), 2 deletions(-)

diff --git a/pkgs/development/python-modules/pyscf/default.nix b/pkgs/development/python-modules/pyscf/default.nix
index 7219869ab6c7..dad52daf0e76 100644
--- a/pkgs/development/python-modules/pyscf/default.nix
+++ b/pkgs/development/python-modules/pyscf/default.nix
@@ -24,14 +24,14 @@
 
 buildPythonPackage rec {
   pname = "pyscf";
-  version = "2.12.0";
+  version = "2.12.1";
   format = "setuptools";
 
   src = fetchFromGitHub {
     owner = "pyscf";
     repo = "pyscf";
     tag = "v${version}";
-    hash = "sha256-/C8BKUNtp8QoSjbcSZGH2Si4JjygIygW04wtL8vGXLk=";
+    hash = "sha256-voiXNoJ7lHQeqroOs9AxqX55NDEhHVNMLeB+XzJgBQM=";
   };
 
   # setup.py calls Cmake and passes the arguments in CMAKE_CONFIGURE_ARGS to cmake.

From 01c51bf6f6d930b7f822509f984938263f5cdceb Mon Sep 17 00:00:00 2001
From: Phillip Seeber <phillip.seeber@uni-jena.de>
Date: Mon, 9 Feb 2026 11:05:51 +0100
Subject: [PATCH 2/2] python3Packages.pyscf: disable another numerically off
 test

---
 pkgs/development/python-modules/pyscf/default.nix | 1 +
 1 file changed, 1 insertion(+)

diff --git a/pkgs/development/python-modules/pyscf/default.nix b/pkgs/development/python-modules/pyscf/default.nix
index dad52daf0e76..f139162a6b19 100644
--- a/pkgs/development/python-modules/pyscf/default.nix
+++ b/pkgs/development/python-modules/pyscf/default.nix
@@ -96,6 +96,7 @@ buildPythonPackage rec {
     "test_collinear_kgks_gga"
     "test_libxc_gga_deriv4"
     "test_sacasscf_grad"
+    "test_sparse_dot"
   ];
 
   disabledTestPaths = [