mp-6402/Na2ZnGeO4/harm

Harmonic properties

../../_images/fig_bandos_pr6398.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos9249.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo6398.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc26188.png

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

Summary

../../_images/fig_times11536.png

(a) Computation time