| 163 |
|
artificially stabilized by the periodic replicas introduced by the |
| 164 |
|
Ewald summation.\cite{Weber00} Thus, care must be taken when |
| 165 |
|
considering the use of the Ewald summation where the assumed |
| 166 |
< |
periodicity would introduce spurious effects in the system dynamics. |
| 166 |
> |
periodicity would introduce spurious effects. |
| 167 |
|
|
| 168 |
|
|
| 169 |
|
\section{The Wolf and Zahn Methods} |
| 1755 |
|
\ref{sec:dampingMultipoles}. Each of these systems were studied with |
| 1756 |
|
cutoff radii of 9, 10, 11, and 12~\AA\ and with damping parameter values |
| 1757 |
|
ranging from 0 to 0.35~\AA$^{-1}$. |
| 1758 |
+ |
|
| 1759 |
|
\begin{figure} |
| 1760 |
|
\centering |
| 1761 |
|
\includegraphics[width=\linewidth]{./figures/dielectricMap.pdf} |
| 1764 |
|
radius ($R_\textrm{c}$) and damping coefficient ($\alpha$).} |
| 1765 |
|
\label{fig:dielectricMap} |
| 1766 |
|
\end{figure} |
| 1766 |
– |
|
| 1767 |
|
The results of these calculations are displayed in figure |
| 1768 |
|
\ref{fig:dielectricMap} in the form of shaded contour plots. An |
| 1769 |
|
interesting aspect of all four contour plots is that the dielectric |
