mp-19760/Na2Mo2O7/harm

Harmonic properties

../../_images/fig_bandos_pr13390.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos17755.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo13390.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc213029.png

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

Summary

../../_images/fig_times22555.png

(a) Computation time