python310Packages.pyscf 0 -> 1
attrpath: python310Packages.pyscf
Checking auto update branch...
[version] 
[version] skipping because derivation has updateScript
[rustCrateVersion] 
[rustCrateVersion] No cargoSha256 or cargoHash found
[golangModuleVersion] 
[golangModuleVersion] Not a buildGoModule package with vendorSha256 or vendorHash
[updateScript] 
[updateScript] Success
[updateScript] this derivation will be built:
  /nix/store/p56gjfdywz1c1mm6b0j04gm1xjnxrllp-packages.json.drv
building '/nix/store/p56gjfdywz1c1mm6b0j04gm1xjnxrllp-packages.json.drv'...

Going to be running update for following packages:
 - python3.10-pyscf-2.2.0

Press Enter key to continue...
Running update for:
 - python3.10-pyscf-2.2.0: UPDATING ...
 - python3.10-pyscf-2.2.0: DONE.

Packages updated!


[quotedUrls]
[quotedUrls] nothing found to replace
Diff after rewrites:
diff --git a/pkgs/development/python-modules/pyscf/default.nix b/pkgs/development/python-modules/pyscf/default.nix
index 55c11fe8f9e..d29d1c9f308 100644
--- a/pkgs/development/python-modules/pyscf/default.nix
+++ b/pkgs/development/python-modules/pyscf/default.nix
@@ -16,13 +16,13 @@
 
 buildPythonPackage rec {
   pname = "pyscf";
-  version = "2.2.0";
+  version = "2.2.1";
 
   src = fetchFromGitHub {
     owner = "pyscf";
     repo = pname;
-    rev = "v${version}";
-    hash = "sha256-3ylFz5j176hBQLklLmVKltE8whynzojsoBEWjEL2M14=";
+    rev = "refs/tags/v${version}";
+    hash = "sha256-dO4lk88UL/EkQfE7Dze2sDgvF4IFAkJ5PVeOVtSmIOM=";
   };
 
   # setup.py calls Cmake and passes the arguments in CMAKE_CONFIGURE_ARGS to cmake.

No auto update branch exists
Received ExitFailure 1 when running
Raw command: /nix/store/3nqhcyc7vid1npgcd0m7arg5sn325nhz-nix-2.12.0/bin/nix-build --option sandbox true --arg config "{ allowBroken = true; allowUnfree = true; allowAliases = false; }" --arg overlays "[ ]" -A python310Packages.pyscf
nix build failed.
Test from_scf and to_scf ... Overwritten attributes  get_hcore get_ovlp  of <class 'pyscf.scf.hf_symm.SymAdaptedRHF'>
ok
test_mo_1to1map (test_mo_mapping.KnowValues) ... ok
test_mo_comps (test_mo_mapping.KnowValues) ... ok
test_mo_map (test_mo_mapping.KnowValues) ... ok
test_dump_cartesian_gto_orbital (test_molden.KnownValues) ... ok
test_dump_cartesian_gto_symm_orbital (test_molden.KnownValues) ... ok
test_dump_scf (test_molden.KnownValues) ... ok
test_dump_uhf (test_molden.KnownValues) ... ok

======================================================================
FAIL: test_nosymm_sa4_newton (test_h2o.KnownValues)
----------------------------------------------------------------------
Traceback (most recent call last):
  File "/build/source/pyscf/mcscf/test/test_h2o.py", line 73, in test_nosymm_sa4_newton
    self.assertAlmostEqual (mc.e_tot, mc_ref.e_tot, 8)
AssertionError: -75.76275456450493 != -75.76275462727395 within 8 places (6.27690184273888e-08 difference)

======================================================================
FAIL: test_veff (test_kgks.KnownValues)
----------------------------------------------------------------------
Traceback (most recent call last):
  File "/build/source/pyscf/pbc/dft/test/test_kgks.py", line 83, in test_veff
    self.assertAlmostEqual(lib.fp(v), -99.365338+0j, 5)
AssertionError: (-99.36534333613761-5.034873664937532e-15j) != (-99.365338+0j) within 5 places (5.3361376188831855e-06 difference)

----------------------------------------------------------------------
Ran 2147 tests in 2884.198s

FAILED (SKIP=37, failures=2)