1mo

Fe6Ni2B_714 - relaxed - 3x3x3 supercell

Name: Fe6Ni2B_714 - relaxed - 3x3x3 supercell
Creator: mmoderwell
License: https://en.wikipedia.org/wiki/All_rights_reserved

Supercell 3x3x3 of Fe6Ni2B (Space group: I4/mmm, 864 symmetry operations)

9 views

26.26 KB

.cif file

1 input asset

.cif file
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -136.7751 eV; energy change = -4.1985 eV; symmetry: I4/mmm → I4/mmm
1mo

Loading compatible actions...

Loading comments...