mp-24440/Na3SbH18S4O9/harm

Harmonic properties

../../_images/fig_bandos_pr12417.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos16692.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo12417.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc212116.png

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

Summary

../../_images/fig_times21098.png

(a) Computation time