mp-759680/LiSi2BiO6/harm

Harmonic properties

../../_images/fig_bandos_pr3075.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos3981.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3075.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22895.png

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

Summary

../../_images/fig_times5287.png

(a) Computation time