mp-1104363/K3ScV2O8/harm

Harmonic properties

../../_images/fig_bandos_pr16613.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20980.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16612.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc216185.png

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

Summary

../../_images/fig_times27169.png

(a) Computation time