mp-759216-2/LiY3WO8/harm

Harmonic properties

../../_images/fig_bandos_pr3041.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos3906.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3041.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22861.png

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

Summary

../../_images/fig_times5208.png

(a) Computation time