mp-1112283/K2InAgF6/harm

Harmonic properties

../../_images/fig_bandos_pr16401.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20830.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16400.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215988.png

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

Summary

../../_images/fig_times26902.png

(a) Computation time