mp-13866/SbO2/harm

Equation of state

../../_images/fig_bm7517.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr14983.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19346.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo14982.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214600.png

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

Summary

../../_images/fig_times24821.png

(a) Computation time