From 8a496da607a64bf563f30a3bfe366a9ff4d2a703 Mon Sep 17 00:00:00 2001 From: sjplimp Date: Fri, 4 Apr 2008 14:24:01 +0000 Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1707 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- doc/compute_pe_atom.html | 2 +- doc/compute_pe_atom.txt | 2 +- 2 files changed, 2 insertions(+), 2 deletions(-) diff --git a/doc/compute_pe_atom.html b/doc/compute_pe_atom.html index 7da6a9cd6a..a8f17e9d6c 100644 --- a/doc/compute_pe_atom.html +++ b/doc/compute_pe_atom.html @@ -60,7 +60,7 @@ energy, these lines in an input script should yield the same result in the last 2 columns of thermo output: 

compute		peratom all pe/atom
-compute		p all sum c_peratom
+compute		p all reduce sum c_peratom
 thermo_style	custom step temp etotal press pe c_p

IMPORTANT NOTE: The per-atom energy does NOT include contributions due diff --git a/doc/compute_pe_atom.txt b/doc/compute_pe_atom.txt index c2ea738ae8..5107e3f810 100644 --- a/doc/compute_pe_atom.txt +++ b/doc/compute_pe_atom.txt @@ -57,7 +57,7 @@ energy, these lines in an input script should yield the same result in the last 2 columns of thermo output: compute peratom all pe/atom -compute p all sum c_peratom +compute p all reduce sum c_peratom thermo_style custom step temp etotal press pe c_p :pre IMPORTANT NOTE: The per-atom energy does NOT include contributions due