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Structural stability and electronic properties of carbon star lattice monolayer

Structural stability and electronic properties of carbon star lattice monolayer
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摘要 By means of the first-principles calculations, we have investigated the structural stability and electronic properties of carbon star lattice monolayer and nanoribbons. The phase stability of the carbon star lattice is verified through phononmode analysis and room temperature molecular dynamics simulations. The carbon star lattice is found to be metallic due to the large states across the Fermi-level contributed by Pz orbital. Furthermore, the nanoribbons are also found to be metallic and no spin polarization occurs, except for the narrowest nanoribbon with one C12 ring, which has a ferromagnetic ground state. Our results show that carbon star lattice monolayer and nanoribbons have rich electronic properties with great potential in future electronic nanodevices. By means of the first-principles calculations, we have investigated the structural stability and electronic properties of carbon star lattice monolayer and nanoribbons. The phase stability of the carbon star lattice is verified through phononmode analysis and room temperature molecular dynamics simulations. The carbon star lattice is found to be metallic due to the large states across the Fermi-level contributed by Pz orbital. Furthermore, the nanoribbons are also found to be metallic and no spin polarization occurs, except for the narrowest nanoribbon with one C12 ring, which has a ferromagnetic ground state. Our results show that carbon star lattice monolayer and nanoribbons have rich electronic properties with great potential in future electronic nanodevices.
出处 《Chinese Physics B》 SCIE EI CAS CSCD 2014年第9期310-313,共4页 中国物理B(英文版)
基金 supported by the National Natural Science Foundation of China(Grant No.11274356) the Ministry of Environmental Protection of China(Grant Nos.200909086 and 201109037)
关键词 carbon star lattice structural stability electronic properties first-principles calculations carbon star lattice, structural stability, electronic properties, first-principles calculations
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