mp-27544/Cs3Bi2Br9/harm

Harmonic properties

../../_images/fig_bandos_pr12134.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos16238.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo12134.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc211835.png

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

Summary

../../_images/fig_times20566.png

(a) Computation time