mp-1103816/BaGaH5/harm

Harmonic properties

../../_images/fig_bandos_pr16595.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20965.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16594.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc216169.png

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

Summary

../../_images/fig_times27143.png

(a) Computation time