mp-776589/Li9Sb3P8O29/harm

Harmonic properties

../../_images/fig_bandos_pr2299.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos2614.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo2299.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22120.png

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

Summary

../../_images/fig_times3743.png

(a) Computation time