From b4eee0c27a0c8d94ff5bdf2bf497c97b5ad3dee8 Mon Sep 17 00:00:00 2001 From: jtclemm Date: Wed, 29 Jan 2025 13:58:47 -0700 Subject: [PATCH] Marking scalar intensive in elec/stop/fit fix --- src/EXTRA-FIX/fix_electron_stopping_fit.cpp | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/src/EXTRA-FIX/fix_electron_stopping_fit.cpp b/src/EXTRA-FIX/fix_electron_stopping_fit.cpp index 2657ddc85f..c9cca2679d 100644 --- a/src/EXTRA-FIX/fix_electron_stopping_fit.cpp +++ b/src/EXTRA-FIX/fix_electron_stopping_fit.cpp @@ -68,7 +68,8 @@ FixElectronStoppingFit::FixElectronStoppingFit(LAMMPS *lmp, int narg, char **arg error->all(FLERR,"Incorrect number of fix electron/stopping/fit arguments"); } - scalar_flag = 1; + scalar_flag = 1; // intensive total energy loss since start of run + extscalar = 0; global_freq = 1; energy_coh_in = new double[atom->ntypes+1];