mp-29459-2/Rb3Mo2Br9/harm

Equation of state

../../_images/fig_bm5479.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr11210.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos15172.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo11210.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc210926.png

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

Summary

../../_images/fig_times19148.png

(a) Computation time