mp-557006/Na2SbSO4F3/harm

Harmonic properties

../../_images/fig_bandos_pr8349.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos11739.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo8349.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc28111.png

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

Summary

../../_images/fig_times14666.png

(a) Computation time