Using
first-principles calculations, the electronic structures
and electron transport properties of zigzag and armchair O-functionalized
Ti2C MXene nanoribbons are examined in this work. We demonstrate
that the energy gaps in patterned Ti2CO2 nanoribbons
can be tuned by appropriate designs of crystallographic orientation
and widths. The Ti2CO2 nanoribbons along the
zigzag direction with width parameter larger than six show zero or
very low band gaps, while band gaps are opened for Ti2CO2 nanoribbons with armchair-shaped edges. The electronic transport
properties for the devices of Ti2CO2 nanoribbons
with various widths are investigated using nonequilibrium Green’s
functions, and the current–voltage characteristics of the devices
are predicted. The current calculations reveal that some of these
devices may have a nonlinear feature as well as negative differential
resistance behaviors. The zigzag and armchair Ti2CO2 nanoribbon devices show different current–voltage
curves. There are onset biases for armchair Ti2CO2 nanoribbons so that the current is generated due to the band gaps
but not for most of the zigzag nanoribbons. The corresponding mechanisms
for the variation of electronic band gaps and electronic transport
properties are discussed. Based on their excellent carrier mobilities
reported for the Ti2CO2 MXene and the negative
differential resistance effect found in this work, the Ti2CO2 nanoribbon systems might find promising applications
in nanoelectronic devices.
The functionality and reliability of the current collector (CC) are crucial to design and fabricate electrodes for Li-ion batteries because the CC serves as the bridge between external electronic and internal Li-ion transports. Therefore, understanding the mechanical behavior of CCs is of great importance for battery design and manufacturing. In this paper, we report the measured values of the elastic moduli of six commercial copper current-collector (CCC) foils. Measurements were performed using three techniques: a standard microtensile testing machine equipped with a laser sensor, dynamic mechanical analysis (DMA), and nanoindentation. For electrolytic copper (E-Cu) foils, we find elastic moduli of approximately 70 GPa, and for rolled copper (R-Cu) foils, we find elastic moduli of approximately 50 GPa. Values for yield strength and fracture strength of the foils were determined from load-deflection curves; the results are consistent with values recommended by the manufacturer. Crystalline structures, which influence values for the elastic moduli of the foils, were investigated by X-ray diffraction. Surface morphologies of the foils before testing and the fracture morphologies after testing were studied by scanning electron microscopy. Figure 4 Yield strength of CCC foils as a function of thickness Figure 5 Fracture strength of CCC foils as a function of thickness. The inset is the real picture of sample after microtensile test.
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