mp-29536/Ag5CF4/harm

Harmonic properties

../../_images/fig_bandos_pr11242.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos15208.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo11242.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc210958.png

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

Summary

../../_images/fig_times19196.png

(a) Computation time