mp-19105/Na3MoNO3/harm

Harmonic properties

../../_images/fig_bandos_pr13685.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_thermo13685.png

(b) Thermodynamic properties

Force constants

../../_images/fig_fc213313.png

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

Summary

../../_images/fig_times22973.png

(a) Computation time