mp-13866-2/SbO2/harm

Harmonic properties

../../_images/fig_bandos_pr14984.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19347.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo14983.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214601.png

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

Summary

../../_images/fig_times24822.png

(a) Computation time