Mn2PS5 phase diagram

Name: Mn2PS5 phase diagram
Creator: will
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Phase diagram of Mn2PS5 with Orb v3 conservative inf MPA; e_above_hull: 0.213093 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 = -92.5823 eV; energy change = -49.6932 eV; symmetry: I41/amd → I41/amd
2h
.cif