mp-757042-2/LiSnPO4/harm

Harmonic properties

../../_images/fig_bandos_pr3110.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos4057.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3110.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22930.png

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

Summary

../../_images/fig_times5370.png

(a) Computation time