mp-18495-2/SrLiB9O15/harm

Harmonic properties

../../_images/fig_bandos_pr13893.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos18293.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo13893.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc213521.png

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

Summary

../../_images/fig_times23287.png

(a) Computation time