Temperature Dependence Study of Water Dynamics in Fluorohectorite Clays Using Molecular Dynamics Simulations

<div>Snapshot of the pre-equilibrium systems with 48 interlayer cations, 480 water molecules, and Na-fluorohectorite clay with two layers. Colors: O (red), H (white), Si (dark yellow), Mg (green), Na (purple), and F (light skyblue). To generate models for other M-fluorohectorite clays, Na is replaced with other <i>M</i>-ions (<i>M</i> = Li, K, Cs).</div>

Advances in Condensed Matter Physics

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Figure 1

Figure 1: Temperature Dependence Study of Water Dynamics in Fluorohectorite Clays Using Molecular Dynamics Simulations 