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Characterization of channel diffusion in a sodium tetrasilicate glass via molecular-dynamics simulations

Characterization of channel diffusion in a sodium tetrasilicate glass via molecular-dynamics simulations

We study the structural and dynamical characteristics of the sodium atoms inside and outside the ``diffusion channels'' in glassy Na$_2$O-4SiO$_2$ (NS4) using classical molecular dynamics. We show that on average neither energetic arguments nor local environment considerations can explain the increased density of sodium atoms inside the subspace made of …