Thermal properties of black and blue phosphorenes from a first-principles quasiharmonic approach

Different allotropes of phosphorene are possible of which black and blue phosphorus are the most stable. While blue phosphorus has isotropic properties, black phosphorus is strongly anisotropic in its electronic and optical properties due to its anisotropic crystal structure. In this work, we system...

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Veröffentlicht in:	Physical review. B, Condensed matter and materials physics Condensed matter and materials physics, 2015-08, Vol.92 (8), Article 081408
Hauptverfasser:	Aierken, Yierpan, Çakır, Deniz, Sevik, Cem, Peeters, Francois M.
Format:	Artikel
Sprache:	eng
Schlagworte:	Anisotropy Approximation Chairs Condensed matter Crystal structure Mathematical analysis Phosphorus Thermal properties
Online-Zugang:	Volltext
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