mp-768241/Dy2Ge2O7/harm

Harmonic properties

../../_images/fig_bandos_pr2819.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos3501.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo2819.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22640.png

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

Summary

../../_images/fig_times4751.png

(a) Computation time