Forgot file

2017-04-21 23:18:09 +02:00 · 2017-04-21 23:18:09 +02:00 · 6fc08e610d
parent 23d7794109
commit 6fc08e610d
1 changed files with 10 additions and 0 deletions
--- a/plugins/Perturbation/var_pt2_ratio_provider.irp.f
+++ b/plugins/Perturbation/var_pt2_ratio_provider.irp.f
@ -0,0 +1,10 @@
+BEGIN_PROVIDER [ double precision, var_pt2_ratio  ]
+  implicit none
+  BEGIN_DOC
+  ! The selection process stops when the energy ratio variational/(variational+PT2)
+  ! is equal to var_pt2_ratio
+  END_DOC
+  
+  var_pt2_ratio = correlation_energy_ratio_max 
+END_PROVIDER
+