From ae227aac33290e8689f8543d8698afda8af563a5 Mon Sep 17 00:00:00 2001 From: Abdallah Ammar Date: Wed, 17 May 2023 01:21:22 +0200 Subject: [PATCH] todo: multiply F_TC by 0.5 --- src/tc_scf/rh_tcscf_diis.irp.f | 5 +++++ 1 file changed, 5 insertions(+) diff --git a/src/tc_scf/rh_tcscf_diis.irp.f b/src/tc_scf/rh_tcscf_diis.irp.f index 5901911c..61355498 100644 --- a/src/tc_scf/rh_tcscf_diis.irp.f +++ b/src/tc_scf/rh_tcscf_diis.irp.f @@ -1,5 +1,10 @@ ! --- +! TODO +! level shift of SCF is well adapted +! for 0.5 x F +! + subroutine rh_tcscf_diis() implicit none