mp-857354/LiSn3SbP6O24/harm

Harmonic properties

../../_images/fig_bandos_pr1733.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos1737.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo1733.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc21565.png

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

Summary

../../_images/fig_times2643.png

(a) Computation time