most citedFinite temperature effects on the structural stability of Si-doped HfO using first-principles calculations

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cond-mat.mtrl-sci2023★ 6 cited

Finite temperature effects on the structural stability of Si-doped HfO using first-principles calculations

Yosuke Harashima, Hiroaki Koga, Zeyuan Ni +9

The structural stabilities of the monoclinic and tetragonal phases of Si-doped HfO at finite temperatures were analyzed using a computational scheme to assess the effects of…