mp-698350/Na3AlH10C6O17/harm

Harmonic properties

../../_images/fig_bandos_pr4727.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos6573.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo4727.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc24538.png

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

Summary

../../_images/fig_times8388.png

(a) Computation time