mp-18784/DyVO4/harm

Harmonic properties

../../_images/fig_bandos_pr13615.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos17975.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo13615.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc213243.png

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

Summary

../../_images/fig_times22872.png

(a) Computation time