mp-767393/Li15Ti11Nb5O42/harm

Harmonic properties

../../_images/fig_bandos_pr2790.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos3450.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo2790.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22611.png

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

Summary

../../_images/fig_times4693.png

(a) Computation time