From d6a1220341640a3ffdeebec091248f69efafc3fd Mon Sep 17 00:00:00 2001
From: sjplimp <sjplimp@f3b2605a-c512-4ea7-a41b-209d697bcdaa>
Date: Mon, 6 Aug 2012 21:20:08 +0000
Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8533
 f3b2605a-c512-4ea7-a41b-209d697bcdaa

---
 doc/kspace_style.html | 41 ++++++++++++++++++++++-------------------
 doc/kspace_style.txt  | 38 +++++++++++++++++++++-----------------
 2 files changed, 43 insertions(+), 36 deletions(-)

diff --git a/doc/kspace_style.html b/doc/kspace_style.html
index 2df6f8331d..5ccc5bd3c1 100644
--- a/doc/kspace_style.html
+++ b/doc/kspace_style.html
@@ -15,11 +15,15 @@
 </P>
 <PRE>kspace_style style value 
 </PRE>
-<UL><LI>style = <I>none</I> or <I>ewald</I> or <I>pppm</I> or <I>pppm/cg</I> or <I>pppm/tip4p</I> or <I>ewald/n</I> or <I>pppm/gpu</I> or <I>ewald/omp</I> or <I>pppm/omp</I> or <I>pppm/cg/omp</I> or <I>pppm/tip4p/omp</I> or <I>pppm/proxy</I> or <I>pppm/tip4p/proxy</I> 
+<UL><LI>style = <I>none</I> or <I>ewald</I> or <I>ewald/omp</I> or <I>ewald/n</I> or <I>pppm</I> or <I>pppm/cg</I> or <I>pppm/tip4p</I> or <I>pppm/gpu</I> or <I>pppm/omp</I> or <I>pppm/cg/omp</I> or <I>pppm/tip4p/omp</I> or <I>pppm/proxy</I> or <I>pppm/tip4p/proxy</I> 
 
 <PRE>  <I>none</I> value = none
   <I>ewald</I> value = accuracy
     accuracy = desired relative error in forces
+  <I>ewald/omp</I> value = accuracy
+    accuracy = desired relative error in forces
+  <I>ewald/n</I> value = accuracy
+    accuracy = desired relative error in forces
   <I>pppm</I> value = accuracy
     accuracy = desired relative error in forces
   <I>pppm/cg</I> value = accuracy (smallq)
@@ -27,20 +31,15 @@
     smallq = cutoff for charges to be considered (optional) (charge units)
   <I>pppm/tip4p</I> value = accuracy
     accuracy = desired relative error in forces
-  <I>ewald/n</I> value = accuracy
-    accuracy = desired relative error in forces
   <I>pppm/gpu</I> value = accuracy
     accuracy = desired relative error in forces
-  <I>ewald/omp</I> value = accuracy
-    accuracy = desired relative error in forces
   <I>pppm/omp</I> value = accuracy
     accuracy = desired relative error in forces
   <I>pppm/tip4p/omp</I> value = accuracy
     accuracy = desired relative error in forces
   <I>pppm/proxy</I> value = accuracy
-    accuracy = desired relative error in forces 
-</PRE>
-<PRE>  <I>pppm/tip4p/proxy</I> value = accuracy
+    accuracy = desired relative error in forces
+  <I>pppm/tip4p/proxy</I> value = accuracy
     accuracy = desired relative error in forces 
 </PRE>
 
@@ -60,9 +59,24 @@ style, the cutoff for Coulombic or other 1/r^N interactions is
 effectively infinite; each charge in the system interacts with charges
 in an infinite array of periodic images of the simulation domain.
 </P>
+<HR>
+
 <P>The <I>ewald</I> style performs a standard Ewald summation as described in
 any solid-state physics text.
 </P>
+<P>The <I>ewald/n</I> style augments <I>ewald</I> by adding long-range dispersion
+sum capabilities for 1/r^N potentials and is useful for simulation of
+interfaces <A HREF = "#Veld">(Veld)</A>.  It also performs standard coulombic Ewald
+summations, but in a more efficient manner than the <I>ewald</I> style.
+The 1/r^N capability means that Lennard-Jones or Buckingham potentials
+can be used with <I>ewald/n</I> without a cutoff, i.e. they become full
+long-range potentials.
+</P>
+<P>Currently, only the <I>ewald/n</I> style can be used with non-orthogonal
+(triclinic symmetry) simulation boxes.
+</P>
+<HR>
+
 <P>The <I>pppm</I> style invokes a particle-particle particle-mesh solver
 <A HREF = "#Hockney">(Hockney)</A> which maps atom charge to a 3d mesh, uses 3d FFTs
 to solve Poisson's equation on the mesh, then interpolates electric
@@ -84,17 +98,6 @@ adds a charge at the massless 4th site in each TIP4P water molecule.
 It should be used with <A HREF = "pair_style.html">pair styles</A> with a
 <I>long/tip4p</I> in their style name.
 </P>
-<P>The <I>ewald/n</I> style augments <I>ewald</I> by adding long-range dispersion
-sum capabilities for 1/r^N potentials and is useful for simulation of
-interfaces <A HREF = "#Veld">(Veld)</A>.  It also performs standard coulombic Ewald
-summations, but in a more efficient manner than the <I>ewald</I> style.
-The 1/r^N capability means that Lennard-Jones or Buckingham potentials
-can be used with <I>ewald/n</I> without a cutoff, i.e. they become full
-long-range potentials.
-</P>
-<P>Currently, only the <I>ewald/n</I> style can be used with non-orthogonal
-(triclinic symmetry) simulation boxes.
-</P>
 <P>The <I>pppm/proxy</I> style is a special variant for calculations 
 in hybrid OpenMP/MPI parallel mode. It is functionally equivalent
 with <I>pppm</I>, but it its force computation is being executed 
diff --git a/doc/kspace_style.txt b/doc/kspace_style.txt
index 4a334ff078..c71e5ba2de 100644
--- a/doc/kspace_style.txt
+++ b/doc/kspace_style.txt
@@ -12,10 +12,14 @@ kspace_style command :h3
 
 kspace_style style value :pre
 
-style = {none} or {ewald} or {pppm} or {pppm/cg} or {pppm/tip4p} or {ewald/n} or {pppm/gpu} or {ewald/omp} or {pppm/omp} or {pppm/cg/omp} or {pppm/tip4p/omp} or {pppm/proxy} or {pppm/tip4p/proxy} :ulb,l
+style = {none} or {ewald} or {ewald/omp} or {ewald/n} or {pppm} or {pppm/cg} or {pppm/tip4p} or {pppm/gpu} or {pppm/omp} or {pppm/cg/omp} or {pppm/tip4p/omp} or {pppm/proxy} or {pppm/tip4p/proxy} :ulb,l
   {none} value = none
   {ewald} value = accuracy
     accuracy = desired relative error in forces
+  {ewald/omp} value = accuracy
+    accuracy = desired relative error in forces
+  {ewald/n} value = accuracy
+    accuracy = desired relative error in forces
   {pppm} value = accuracy
     accuracy = desired relative error in forces
   {pppm/cg} value = accuracy (smallq)
@@ -23,18 +27,14 @@ style = {none} or {ewald} or {pppm} or {pppm/cg} or {pppm/tip4p} or {ewald/n} or
     smallq = cutoff for charges to be considered (optional) (charge units)
   {pppm/tip4p} value = accuracy
     accuracy = desired relative error in forces
-  {ewald/n} value = accuracy
-    accuracy = desired relative error in forces
   {pppm/gpu} value = accuracy
     accuracy = desired relative error in forces
-  {ewald/omp} value = accuracy
-    accuracy = desired relative error in forces
   {pppm/omp} value = accuracy
     accuracy = desired relative error in forces
   {pppm/tip4p/omp} value = accuracy
     accuracy = desired relative error in forces
   {pppm/proxy} value = accuracy
-    accuracy = desired relative error in forces :pre
+    accuracy = desired relative error in forces
   {pppm/tip4p/proxy} value = accuracy
     accuracy = desired relative error in forces :pre
 :ule
@@ -54,9 +54,24 @@ style, the cutoff for Coulombic or other 1/r^N interactions is
 effectively infinite; each charge in the system interacts with charges
 in an infinite array of periodic images of the simulation domain.
 
+:line
+
 The {ewald} style performs a standard Ewald summation as described in
 any solid-state physics text.
 
+The {ewald/n} style augments {ewald} by adding long-range dispersion
+sum capabilities for 1/r^N potentials and is useful for simulation of
+interfaces "(Veld)"_#Veld.  It also performs standard coulombic Ewald
+summations, but in a more efficient manner than the {ewald} style.
+The 1/r^N capability means that Lennard-Jones or Buckingham potentials
+can be used with {ewald/n} without a cutoff, i.e. they become full
+long-range potentials.
+
+Currently, only the {ewald/n} style can be used with non-orthogonal
+(triclinic symmetry) simulation boxes.
+
+:line
+
 The {pppm} style invokes a particle-particle particle-mesh solver
 "(Hockney)"_#Hockney which maps atom charge to a 3d mesh, uses 3d FFTs
 to solve Poisson's equation on the mesh, then interpolates electric
@@ -78,17 +93,6 @@ adds a charge at the massless 4th site in each TIP4P water molecule.
 It should be used with "pair styles"_pair_style.html with a
 {long/tip4p} in their style name.
 
-The {ewald/n} style augments {ewald} by adding long-range dispersion
-sum capabilities for 1/r^N potentials and is useful for simulation of
-interfaces "(Veld)"_#Veld.  It also performs standard coulombic Ewald
-summations, but in a more efficient manner than the {ewald} style.
-The 1/r^N capability means that Lennard-Jones or Buckingham potentials
-can be used with {ewald/n} without a cutoff, i.e. they become full
-long-range potentials.
-
-Currently, only the {ewald/n} style can be used with non-orthogonal
-(triclinic symmetry) simulation boxes.
-
 The {pppm/proxy} style is a special variant for calculations 
 in hybrid OpenMP/MPI parallel mode. It is functionally equivalent
 with {pppm}, but it its force computation is being executed