mp-754466-2/Li2AgF3/harm

Harmonic properties

../../_images/fig_bandos_pr3871.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos5124.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3871.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc23684.png

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

Summary

../../_images/fig_times6688.png

(a) Computation time