mp-754663-2/Na2Be2O3/harm

Harmonic properties

../../_images/fig_bandos_pr3571.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos4792.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3571.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc23389.png

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

Summary

../../_images/fig_times6223.png

(a) Computation time