mp-1223852/InGaAg2S4/harm

Harmonic properties

../../_images/fig_bandos_pr15038.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19385.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15037.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214655.png

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

Summary

../../_images/fig_times24887.png

(a) Computation time