Atomic scale structure and dynamical properties of (TeO${}_2$)${}_{1-x}$-(Na${}_2$O)${}_x$ glasses through first-principles modeling and XRD measurements

Firas Shuaib, Assil Bouzid, Remi Piotrowski +10

We resort to first-principles molecular dynamics, in synergy with experiments, to study structural evolution and Na${}^{+}$ cation diffusion inside (TeO${}_2$)${}_{1-x}$-(Na${}_2$O)${}_x$ (x…