mp-753533/Li3VF8/harm

Harmonic properties

../../_images/fig_bandos_pr4017.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos5346.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo4017.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc23830.png

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

Summary

../../_images/fig_times6956.png

(a) Computation time