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The inelastic electron tunneling spectroscopy of edge-modified graphene nanoribbon-based molecular devices 下载免费PDF全文
The inelastic electron tunneling spectroscopy(IETS) of four edge-modified finite-size grapheme nanoribbon(GNR)-based molecular devices has been studied by using the density functional theory and Green's function method. The effects of atomic structures and connection types on inelastic transport properties of the junctions have been studied. The IETS is sensitive to the electrode connection types and modification types. Comparing with the pure hydrogen edge passivation systems, we conclude that the IETS for the lower energy region increases obviously when using donor–acceptor functional groups as the edge modification types of the central scattering area. When using donor–acceptor as the electrode connection groups, the intensity of IETS increases several orders of magnitude than that of the pure ones. The effects of temperature on the inelastic electron tunneling spectroscopy also have been discussed. The IETS curves show significant fine structures at lower temperatures. With the increasing of temperature, peak broadening covers many fine structures of the IETS curves.The changes of IETS in the low-frequency region are caused by the introduction of the donor–acceptor groups and the population distribution of thermal particles. The effect of Fermi distribution on the tunneling current is persistent. 相似文献
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Electronic properties of both Pb and S vacancy defects in PbS(1^-00) have been studied using the first-principles density functional theory (DFT) calculations with the plane-wave pseudopotentials. It is found that the density of states (DOS) near the top of the valence band and the bottom of the conduction band is significantly modified by these defects. Our calculation indicates that in the case of S vacancy defects the Fermi energy shifts to the conduction band making it as an n-type PbS (donor). However, in the case of Pb vacancy, because of the appreciable change of the DOS, the system acts as a p-type PbS (accepter). In addition, the structural relaxation shows that the defect leads to outward relaxation of the nearest-neighbouring atoms and inward relaxation of the next-nearest neighbouring atoms. 相似文献
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基于LabVIEW的数据采集卡控制和温度采集方法研究 总被引:2,自引:0,他引:2
设计了基于数据采集卡和LabVIEW的热电偶温度测量系统框图。实验结果表明该数据采集系统能够准确采集到室温环境的温度数值,并具有操作方便、直观、易于保存、精度较高等特点。 相似文献
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Strong spin frustration and magnetism in kagomé antiferromagnets LnCu3(OH)6Br3(Ln = Nd,Sm, and Eu) 下载免费PDF全文
To study the effects of lanthanide ions on the geometrically frustrated antiferromagnets and their magnetic properties,we grew high-quality single crystals of LnCu3(OH)6Br3(Ln=Nd,Sm,and Eu) by hydrothermal method and studied their crystal structures and magnetic properties.The refinements of the crystal structure referred to the powder x-ray diffraction data show that LnCu3(OH)6Br3 adopt a Kapellasite-type layer structure,which is... 相似文献
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