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Jun 28

LiMg2Mn3O8 phase diagram

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LiMg2Mn3O8 phase diagram · Files on Ouro

Jun 28

LiMg2Mn3O8 phase diagram

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Created by route

Calculate energy above the convex hull

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template-LiMg2Mn3O8 - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -93.9706 eV; energy change = -0.0015 eV; symmetry: R3m → R3m

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Phase diagram of LiMg2Mn3O8 with Orb v3 conservative inf MPA; e_above_hull: 0.001003 eV/atom; predicted_stable: True

No compatible actions yet

Created by route

Calculate energy above the convex hull

Connections

1

Inputs

template-LiMg2Mn3O8 - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -93.9706 eV; energy change = -0.0015 eV; symmetry: R3m → R3m