mp-27310/Na4Sn3F10/harm

Harmonic properties

../../_images/fig_bandos_pr12033.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos16095.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo12033.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc211736.png

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

Summary

../../_images/fig_times20394.png

(a) Computation time