mp-753751-2/LiAgF2/harm

Harmonic properties

../../_images/fig_bandos_pr3736.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos4978.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3736.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc23551.png

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

Summary

../../_images/fig_times6483.png

(a) Computation time