From 080a69a855cae427cb1f69bb9654b260de908183 Mon Sep 17 00:00:00 2001 From: Marcin Kirsz <marcin.kirsz@ed.ac.uk> Date: Tue, 28 Jan 2025 16:05:55 +0000 Subject: [PATCH] Update d2_mjoin.h --- include/tadah/models/descriptors/d2/d2_mjoin.h | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/include/tadah/models/descriptors/d2/d2_mjoin.h b/include/tadah/models/descriptors/d2/d2_mjoin.h index fc22f65..6224733 100644 --- a/include/tadah/models/descriptors/d2/d2_mjoin.h +++ b/include/tadah/models/descriptors/d2/d2_mjoin.h @@ -19,11 +19,11 @@ * * ``` * TYPE2B D2_mJoin # <-- Meta descriptor for concatenating two-body descriptors - * TYPE2B D2_MIE 11 6 # <-- MIE exponents + * TYPE2B D2_MIE 11 6 Ti Ti # <-- MIE exponents * RCTYPE2B Cut_Cos * RCUT2B 3.0 * - * TYPE2B D2_Blip 6 6 # <-- grid sizes + * TYPE2B D2_Blip 6 6 Ti Nb Nb Nb # <-- grid sizes * RCTYPE2B Cut_Tanh * RCUT2B 7.5 * SGRID2B -2 6 0.1 10 # Grid for D2_Blip, blips widths, auto generated -- GitLab