mp-756935-2/Li3SbO3/harm

Equation of state

../../_images/fig_bm1614.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr3380.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos4507.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3380.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc23199.png

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

Summary

../../_images/fig_times5875.png

(a) Computation time