First-principles study on δ-Pu surface stability

δ-Pu has been widely used due to its outstanding material properties, and surface stability is essential for studying its surface corrosion mechanism. In this work, δ-Pu and its surface stability were analyzed based on first-principles calculations. The third-order Birch–Murnaghan equation of state...

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Veröffentlicht in:	AIP advances 2022-06, Vol.12 (6), p.065001-065001-6
Hauptverfasser:	Xiong, Qing, Wang, Jintao, Hang, Guiyun, Yu, Wenli, Wang, Tao
Format:	Artikel
Sprache:	eng
Schlagworte:	Corrosion mechanisms Corrosion tests Crystal structure Electronic structure Equations of state First principles Lattice parameters Material properties Quasi Newton methods Stability analysis Surface energy Surface stability Surface structure
Online-Zugang:	Volltext
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