mp-675750-2/CaGa6Te10/harm

Harmonic properties

../../_images/fig_bandos_pr5259.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos7510.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo5259.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc25064.png

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

Summary

../../_images/fig_times9459.png

(a) Computation time