mp-734169/Na3SbS4O9/harm

Harmonic properties

../../_images/fig_bandos_pr4090.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos5506.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo4090.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc23903.png

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

Summary

../../_images/fig_times7121.png

(a) Computation time