mp-1192718/SbH5Cl6O2/harm

Harmonic properties

../../_images/fig_bandos_pr15807.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20197.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15806.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215402.png

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

Summary

../../_images/fig_times26043.png

(a) Computation time