From 3e00ba78234daf63018ff0c82456ed189262506e Mon Sep 17 00:00:00 2001 From: sjplimp Date: Tue, 21 Jan 2014 15:15:38 +0000 Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11278 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- src/respa.cpp | 5 ++++- 1 file changed, 4 insertions(+), 1 deletion(-) diff --git a/src/respa.cpp b/src/respa.cpp index 3d0e71a7a5..720527d6f6 100644 --- a/src/respa.cpp +++ b/src/respa.cpp @@ -471,7 +471,10 @@ void Respa::run(int n) ev_set(ntimestep); recurse(nlevels-1); - sum_flevel_f(); // needed in case end_of_step or output use f + + // needed in case end_of_step() or output() use total force + + sum_flevel_f(); if (modify->n_end_of_step) modify->end_of_step();