mp-1208162/Tl2GeF6/harm

Harmonic properties

../../_images/fig_bandos_pr15494.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19860.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15493.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215089.png

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

Summary

../../_images/fig_times25590.png

(a) Computation time