mp-755742/Ho2Sb2O7/harm

Equation of state

../../_images/fig_bm1684.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr3471.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos4631.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3471.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc23289.png

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

Summary

../../_images/fig_times6028.png

(a) Computation time