mp-18388-2/Ga7Te10/harm

Equation of state

../../_images/fig_bm6941.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr13865.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos18260.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo13865.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc213493.png

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

Summary

../../_images/fig_times23244.png

(a) Computation time