mp-776293/Na4Sb2C4SO16/harm

Harmonic properties

../../_images/fig_bandos_pr2275.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos2551.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo2275.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22096.png

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

Summary

../../_images/fig_times3675.png

(a) Computation time