erreur ds 00440

test/CuO_00440/INPUT

+
+ &sassinp
+   prefix="cuo",
+   prt_cipci=.false.,
+   restart=.false.
+   lexplicitHmat = .false.,
+   method="CAS+S"
+   iprint=1
+ &end
+
+ &infomolcasinp
+   nirrep=1, 
+   ntot=8, 
+   iIrTb(1,1) = 1, 
+   iChTb(1,1) = 1
+ &end
+
+
+ &orbinp
+   norb_gel  = 40, 
+   norb_occ  = 0, 
+   norb_ligo = 0, 
+   norb_act  = 4, 
+   norb_ligv = 4, 
+   norb_virt = 0, 
+   norb_del  = 70
+ &end
+
+ &vecinp
+  stot=1, 
+  sz=0, 
+  vec_irrep=1, 
+  nvec=2, 
+  nref0=1, 
+  nelact = 2
+ &end
+
+ &davidinp
+  NiterDavidson = 50,
+  SizeheffDavidson = 5,
+  tol_conv = 1.d-16,
+ &end
+
+ &propinp
+   nprop = 2,
+   whichprop="WF", "dens"
+ &end

test/CuO_00440/cuo.TraInt

+../CuO_02204/cuo.TraInt
\ No newline at end of file

test/CuO_00440/cuo.TraOne

+../CuO_02204/cuo.TraOne
\ No newline at end of file

test/CuO_00440/cuo.propout

+ ***********************************************
+
+         Programme  PROPRIETES du SASS
+
+ ***********************************************
+ DEBUG VersionT
+ Calculation started on 14-01-2022 at 13:37
+
+ >>> Method cas+s   
+ >>> Ouverture des fichiers
+propo :                                                                     cuo.propout
+ bdet :                                                                        cuo.bdet
+ sass :                                                                        cuo.sass
+resta :                                                                     cuo.restart
+ ref0 :                                                                        cuo.ref0

test/CuO_00440/cuo.ref0

+41u 42d 43u 44d
+
+
+
+

test/CuO_20240/INPUT

@@ -42,3 +42,8 @@
   tol_conv =1.d-16,
  &end
 
+ &propinp
+   nprop = 2,
+   whichprop="WF", "dens"
+ &end
+

test/CuO_20240/test

-#!/usr/bin/env python
-
-import os
-import sys
-
-sys.path.append(os.path.join(os.path.dirname(__file__), '..', '..'))
-sys.path.append(os.path.join(os.path.dirname(__file__), '..'))
-
-from runtest_relaxse import Filter, TestRun
-
-test = TestRun(__file__, sys.argv)
-
-f = Filter()
-
-f.add(string = 'Energies :',
-      abs_tolerance = 1.0e-10)
-
-f.add(string = '|Hv-Ev|  :',
-      abs_tolerance = 1.0e-6)
-
-test.run(['cuo.input'], {'out': f})
-
-sys.exit(test.return_code)