mp-696946-2/BaSn2H2O4/harm

Harmonic properties

../../_images/fig_bandos_pr4932.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos6889.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo4932.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc24741.png

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

Summary

../../_images/fig_times8755.png

(a) Computation time