Changes in tests/regression/Simple_configuration/3/post/test.conf [ebcade:274d45]

File:

• tests/regression/Simple_configuration/3/post/test.conf (modified) (3 diffs)

tests/regression/Simple_configuration/3/post/test.conf

@@ -35 +35 @@
 RelEpsTotalE    1e-07   # relative change in total energy
 RelEpsKineticE  1e-05   # relative change in kinetic energy
-MaxMinStopStep  0       # check every ..th steps
+MaxMinStopStep  1       # check every ..th steps
 MaxMinGapStopStep       0       # check every ..th steps
 
@@ -42 +42 @@
 InitRelEpsTotalE        1e-05   # relative change in total energy
 InitRelEpsKineticE      0.0001  # relative change in kinetic energy
-InitMaxMinStopStep      0       # check every ..th steps
+InitMaxMinStopStep      1       # check every ..th steps
 InitMaxMinGapStopStep   0       # check every ..th steps
 
@@ -54 +54 @@
 Level0Factor    2       # factor by which node number increases from S to 0 level
 RiemannTensor   0       # (Use metric)
-PsiType         0       # 0 - doubly occupied, 1 - SpinUp,SpinDown
+PsiType         1       # 0 - doubly occupied, 1 - SpinUp,SpinDown
 MaxPsiDouble    0       # here: specifying both maximum number of SpinUp- and -Down-states
 PsiMaxNoUp      0       # here: specifying maximum number of SpinUp-states
-PsiMaxNoDown    0       # here: specifying maximum number of SpinDown-states
+PsiMaxNoDown    1       # here: specifying maximum number of SpinDown-states
 AddPsis         0       # Additional unoccupied Psis for bandgap determination