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The transport properties of Li@B24N24 metallofullerene bridging two Au contacts are studied with a combined density functional theory and the non-equilibrium Green’s-function technique. Our calculated results show that the conductance of Li@B24N24 nanocage is generally higher than that of the undoped B24N24 molecule. We calculated the current–voltage characteristics for positive and negative bias voltages. It was found that due to presence of Li in B24N24 nanocage, a novel negative differential resistance (NDR) phenomenon is observed. Furthermore, the transmission coefficients of the Li@B24N24 metallofullerene at various external biases are analyzed and it indicates that the broadening of the transmission coefficient spectrum with increasing of the external biases confirms the NDR behavior at the I–V characteristic. 相似文献
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Nonlinear Dynamics - The main target of this investigation is to develop a new numerical method for solving a class of wave models, i.e., the Korteweg–de Vries–Rosenau-regularized... 相似文献
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Mohsen Taghizadeh Ali Akbar Asgharinezhad Noorallah Samkhaniany Azadeh Tadjarodi Abolfazl Abbaszadeh Mohsen Pooladi 《Mikrochimica acta》2014,181(5-6):597-605
We report that magnetic multiwalled carbon nanotubes functionalized with 8-aminoquinoline can be applied to the preconcentration of Cd(II), Pb(II) and Ni(II) ions. The parameters affecting preconcentration were optimized by a Box-Behnken design through response surface methodology. Three variables (extraction time, magnetic sorbent amount, and pH value) were selected as the main factors affecting sorption, and four variables (type, volume and concentration of the eluent; elution time) were selected for optimizing elution. Following sorption and elution, the ions were quantified by FAAS. The LODs are 0.09, 0.72, and 1.0 ng mL?1 for Cd(II), Ni(II), and Pb(II) ions, respectively. The relative standard deviations are <5.1 % for five separate batch determinations at 30 ng mL?1 level of Cd(II), Ni(II), and Pb(II) ions. The sorption capacities (in mg g?1) of this new sorbent are 201 for Cd(II), 150 for Pb(II), and 172 Ni(II). The composite was successfully applied to the rapid extraction of trace quantities of heavy metal ions in fish, sediment, soil, and water samples. Figure
A schematic diagram for synthesis of functionalized magnetic multiwalled carbon nanotube. 相似文献