mp-14433-2/NaGe2N3/harm

Space group: Cmc2_1 (36)
Link: Materials Project
Download: mp-14433-2.tar.gz

Equation of state

../../_images/fig_bm7407.png — (a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr14804.png — (a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19174.png — (b) Phonon dispersion and DOS

../../_images/fig_thermo14804.png — (c) Thermodynamic properties

Grüneisen parameters

../../_images/fig_gru_all6343.png — (a) Grüneisen parameters

../../_images/fig_gruneisen6343.png — (b) Phonon dispersion with Grüneisen parameters

Force constants

../../_images/fig_fc214422.png — (a) Force constants w.r.t atomic distance

Summary

../../_images/fig_times24575.png — (a) Computation time