BaNiO2 phase diagram

Name: BaNiO2 phase diagram
Creator: will
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Phase diagram of BaNiO2 with Orb v3 conservative inf MPA; e_above_hull: 0.588781 eV/atom; predicted_stable: False

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Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -20.7910 eV; energy change = -0.0441 eV; symmetry: P4/mmm → P4/mmm
3h
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