mp-1111432/K2RbRhF6/harm

Harmonic properties

../../_images/fig_bandos_pr16370.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20804.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16369.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215960.png

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

Summary

../../_images/fig_times26871.png

(a) Computation time