mp-27563/Rb2In4O7/harm

Equation of state

../../_images/fig_bm5957.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr12144.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos16246.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo12144.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc211845.png

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

Summary

../../_images/fig_times20578.png

(a) Computation time