From da538e76401e47a5e221b2f5a2aeedd91c0a36ae Mon Sep 17 00:00:00 2001 From: Max Liu Date: Tue, 17 Jan 2017 16:39:33 -0500 Subject: [PATCH] Fix bug in disproportionation tree H_rad is child of Y_rad, so it should not be listed in the top logic node. Also move H_rad higher in the tree since it's a common radical. --- input/kinetics/families/Disproportionation/groups.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/input/kinetics/families/Disproportionation/groups.py b/input/kinetics/families/Disproportionation/groups.py index 67495591b8..961761e105 100644 --- a/input/kinetics/families/Disproportionation/groups.py +++ b/input/kinetics/families/Disproportionation/groups.py @@ -24,7 +24,7 @@ entry( index = 1, label = "Y_rad_birad_trirad_quadrad", - group = "OR{Y_1centerquadrad, Y_1centertrirad, Y_2centerbirad, Y_1centerbirad, Y_rad, H_rad}", + group = "OR{Y_1centerquadrad, Y_1centertrirad, Y_2centerbirad, Y_1centerbirad, Y_rad}", kinetics = None, ) @@ -2727,6 +2727,7 @@ L3: CH2_triplet L3: NH_triplet L2: Y_rad + L3: H_rad L3: Ct_rad L4: Ct_rad/Ct L4: Ct_rad/Nt @@ -2810,7 +2811,6 @@ L5: N3d_rad/N L3: N5_rad L4: N5d_rad - L3: H_rad L1: XH_Rrad_birad L2: XH_Rrad L3: XH_s_Rrad