mp-6391-2/Na2ZnSiO4/harm

Equation of state

../../_images/fig_bm3382.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr6394.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos9243.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo6394.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc26184.png

(a) Force constants w.r.t atomic distance

Summary

../../_images/fig_times11530.png

(a) Computation time