mp-1191568/La3BeSbS7/harm

Harmonic properties

../../_images/fig_bandos_pr15739.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20096.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15738.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215334.png

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

Summary

../../_images/fig_times25923.png

(a) Computation time