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lammps-tutorials.tex

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@@ -198,7 +198,7 @@ \section{Introduction}
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Molecular simulations can be used to model a large variety of
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atomic and coarse-grained systems, including solids, fluids, polymers,
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and biomolecules, as well as complex interfaces and multi-component
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systems. While various molecular modeling methods exist, Molecular dynamics (MD) and
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systems. While various molecular modeling methods exist, molecular dynamics (MD) and
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Monte Carlo (MC) are most commonly used. MD is the preferred method for
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obtaining the accurate dynamics of a system, as it relies on solving
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Newton's equations of motion. For systems with many degrees of freedom
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along the $x$-axis. The simulation box is initially 12.0~nm in the two other dimensions before densification,
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making it straightforward to fill the box with styrene.
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To add 200 styrene molecules to the simulation box, we will use the
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\href{\filepath tutorialteams8/styrene.mol}{\dwlcmd{styrene.mol}} molectule template file.
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\href{\filepath tutorial8/styrene.mol}{\dwlcmd{styrene.mol}} molecule template file.
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Include the following commands to \flecmd{mixing.lmp}:
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\begin{lstlisting}
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molecule styrene styrene.mol

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