3mo

crystal_3793 - relaxed

Name: crystal_3793 - relaxed
Creator: mmoderwell
License: https://en.wikipedia.org/wiki/All_rights_reserved

Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -39.3731 eV; energy change = 0.0000 eV; symmetry: C2/m → C2/m

18 views

953.00 B

.cif file

1 input asset

1 derivative asset

TiO2 phase diagram 2
.html file
Phase diagram of TiO2; e_above_hull: 2.410386 eV/atom; predicted_stable: False
3mo

Loading compatible actions...

Loading comments...