mp-776261/Na5Sn2PC4O16/harm

Harmonic properties

../../_images/fig_bandos_pr2266.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos2537.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo2266.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22087.png

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

Summary

../../_images/fig_times3658.png

(a) Computation time