From c6d34a26f6d75369facd334ef20d9885f760191a Mon Sep 17 00:00:00 2001 From: sjplimp Date: Mon, 21 Jun 2010 14:49:05 +0000 Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4327 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- src/compute_pair_local.cpp | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/compute_pair_local.cpp b/src/compute_pair_local.cpp index b1bfcbe8b5..cbb779b6c1 100644 --- a/src/compute_pair_local.cpp +++ b/src/compute_pair_local.cpp @@ -192,7 +192,7 @@ int ComputePairLocal::compute_pairs(int flag) if (eflag >= 0 || fflag >= 0) { eng = pair->single(i,j,itype,jtype,rsq,factor_coul,factor_lj,fpair); if (eflag >= 0) ebuf[n] = eng; - if (fflag >= 0) fbuf[n] = fpair; + if (fflag >= 0) fbuf[n] = sqrt(rsq)*fpair; } n += nvalues; }