mp-755821-2/Li5CuP2O8/harm

Harmonic properties

../../_images/fig_bandos_pr3490.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos4659.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3490.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc23308.png

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

Summary

../../_images/fig_times6064.png

(a) Computation time