mp-1193056/Cs2Mo3O10/harm

Harmonic properties

../../_images/fig_bandos_pr15821.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20213.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15820.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215416.png

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

Summary

../../_images/fig_times26064.png

(a) Computation time