mp-764966/Na2B8O13/harm

Harmonic properties

../../_images/fig_bandos_pr2984.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos3779.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo2984.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22804.png

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

Summary

../../_images/fig_times5074.png

(a) Computation time