mp-554823/Na2SnC4O8/harm

Equation of state

../../_images/fig_bm4428.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr8777.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos12354.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo8777.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc28538.png

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

Summary

../../_images/fig_times15385.png

(a) Computation time