most citedModeling the iron oxides and oxyhydroxides for the prediction of environmentally sensitive phase transformations

74 citations · 74 across the 1 of their papers we have counts for

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1 paper

cond-mat.str-el2011★ 74 cited

Modeling the iron oxides and oxyhydroxides for the prediction of environmentally sensitive phase transformations

Haibo Guo, Amanda S. Barnard

Iron oxides and oxyhydroxides are challenging to model computationally as competing phases may differ in formation energies by only several kJ/mol, they undergo magnetization trans…