[ViewVC] Diff of: group/trunk/oopsePaper/EmpericalEnergy.tex

Comparing trunk/oopsePaper/EmpericalEnergy.tex (file contents):
Revision 972 by mmeineke, Wed Jan 21 18:40:38 2004 UTC vs.
Revision 973 by mmeineke, Wed Jan 21 19:00:23 2004 UTC

+density corrected SSD models can be found in reference
+\ref{Gezelter04}.
-<
+!!!Place a {\sc BASS} scheme showing SSD parameters around here!!!
->
+\begin{lstlisting}[caption={[A simulation of {\sc ssd} water]An example file showing a simulation including {\sc ssd} water.},label={sch:ssd}]
->
->
+#include "water.mdl"
-+
+nComponents = 1;
-+
+component{
-+
+  type = "SSD_water";
-+
+  nMol = 864;
-+
+}
-+
-+
+initialConfig = "liquidWater.init";
-+
-+
+forceField = "DUFF";
-+
-+
+/*
-+
+ * The reactionField flag toggles reaction
-+
+ * field corrections.
-+
+ */
-+
-+
+reactionField = false; // defaults to false
-+
+dielectric = 80.0; // dielectric for reaction field
-+
-+
+/*
-+
+ * The following two flags set the cutoff
-+
+ * radius for the electrostatic forces
-+
+ * as well as the skin thickness of the switching
-+
+ * function.
-+
+ */
-+
-+
+electrostaticCutoffRadius  = 9.2;
-+
+electrostaticSkinThickness = 1.38;
-+
-+
+\end{lstlisting}
-+
-+
+\subsection{\label{sec:eam}Embedded Atom Method}
+Several other molecular dynamics packages\cite{dynamo86} exist which have the

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