mp-22168/MnIn2S4/harm

Harmonic properties

../../_images/fig_bandos_pr13024.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos17407.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo13024.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc212704.png

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

Summary

../../_images/fig_times22013.png

(a) Computation time