mp-778064/Ga3NO3/harm

Harmonic properties

../../_images/fig_bandos_pr2154.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos2205.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo2154.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc21975.png

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

Summary

../../_images/fig_times3303.png

(a) Computation time