agent-iteration-1-v02.cif - relaxed

Name: agent-iteration-1-v02.cif - relaxed
Creator: will
License: https://en.wikipedia.org/wiki/All_rights_reserved

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -85.6817 eV; energy change = -99.9416 eV; symmetry: P4/mmm → P1

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.cif file

1 input asset

agent-iteration-1-v02.cif
.cif file
Crystal structure generated by GEPA optimization (iteration 1)
21d

1 derivative asset

Mn8Al8C phase diagram 3
.html file
Phase diagram of Mn8Al8C; e_above_hull: 1.072304 eV/atom; predicted_stable: False
21d

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