mp-989536/Cs2LiNF6/harm

Harmonic properties

../../_images/fig_bandos_pr809.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos719.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo809.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc2708.png

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

Summary

../../_images/fig_times1214.png

(a) Computation time