@@ -2453,7 +2453,7 @@ \subsubsection{System preparation}
24532453group fluid union H2O ions
24542454\end {lstlisting }
24552455The \flecmd {groups.inc} file also defines the \lmpcmd {walltop} and \lmpcmd {wallbot}
2456- groups, which contain the WALL atoms located in the $ z > 0 $ and $ z < 0 $ regions, respectively::
2456+ groups, which contain the WALL atoms located in the $ z > 0 $ and $ z < 0 $ regions, respectively:
24572457\ begin{lstlisting}
24582458group wall type WALL
24592459region rtop block INF INF INF INF 0 INF
@@ -2834,7 +2834,7 @@ \subsubsection{Imposed shearing}
28342834\cite {gravelle2021violations }. Here, the shear rate is
28352835approximately $ \dot {\gamma } = 20 \cdot 10 ^9 \, \text {s}^{-1}$ (Fig.~\ref {fig:NANOSHEAR-profiles }),
28362836the average force on each wall is given by \lmpcmd {f\_ mysf1[1]} and \lmpcmd {f\_ mysf2[1]}
2837- and is approximately $ 2.7 \, \mathrm {kcal/mol/\AA }$ in magnitude. Using a surface area
2837+ and is approximately $ 2.7 \, \mathrm {kcal/mol/\AA {} }$ in magnitude. Using a surface area
28382838for the walls of $ A = 6 \cdot 10 ^{-18}\, \text {m}^2 $ , one obtains an estimate for
28392839the shear viscosity for the confined fluid of $ \eta = 3.1 \, \text {mPa.s}$ using Eq.~\eqref {eq:eta }.
28402840
@@ -4020,7 +4020,7 @@ \subsubsection{Method 2: Umbrella sampling}
40204020The \lmpcmd {spring} command imposes the additional harmonic potential $ V$ with
40214021the previously defined spring constant $ k$ . The center of the harmonic
40224022potential, $ x_\text {des}$ , successively takes values
4023- from $ -28 \, \text {\AA } $ to $ 28 \, \text {\AA }$ . For each value of $ x_\text {des}$ ,
4023+ from $ -28 \, \text {\AA {}} $ to $ 28 \, \text {\AA {} }$ . For each value of $ x_\text {des}$ ,
40244024an equilibration step of 40\, ps is performed, followed by a step
40254025of 400\, ps during which the position of the particle of
40264026type 2 along the $ x$ -axis, $ x_\text {ave}$ , is saved in data files named \flecmd {umbrella-sampling.i.dat},
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