mp-21521/Cs2PbO3/harm

Equation of state

../../_images/fig_bm6662.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr13338.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos17697.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo13338.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc212978.png

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

Summary

../../_images/fig_times22474.png

(a) Computation time