mp-14420/Er2Be2GeO7/harm

Harmonic properties

../../_images/fig_bandos_pr14800.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19169.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo14800.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214418.png

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

Summary

../../_images/fig_times24569.png

(a) Computation time