DFT Analysis of Ferromagnetism in Zigzag and Armchair CuO Nanosheets

We report the structural, electronic, and magnetic properties of “zigzag” and “armchair” CuO nanosheets. The density function theory (DFT)-based ab initio approach has been applied through revised Perdew, Burke, and Ernzerhof (rPBE) parameterized spin generalized-gradient approximation (SGGA) + mean...

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Veröffentlicht in:	Physics of the solid state 2020-08, Vol.62 (8), p.1361-1369
Hauptverfasser:	Yadav, T. P., Srivastava, A., Kaphle, G. C.
Format:	Artikel
Sprache:	eng
Schlagworte:	Analysis Computation Copper oxide Cuprite Density functional theory Electronic devices Energy storage Ferromagnetism Force and energy Gas sensors Magnetic moments Magnetic properties Magnetism Nanosheets Physics Physics and Astronomy Polarization (spin alignment) Solid State Physics Structural stability Unity
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