排序方式: 共有322条查询结果,搜索用时 15 毫秒
61.
Somayeh KhazaeiMohammad Khazaei Hosein CheraghchiVahid Daadmehr Yoshiyuki Kawazoe 《Physica B: Condensed Matter》2011,406(20):3885-3890
We have used a non-equilibrium surface Green's function matching formalism combined with a tight-binding Hamiltonian to consider the effect of different arrangements of pentagon rings on localization of density of states at the tip regions of semi-infinite capped carbon nanotubes. The transfer matrixes are obtained by an iterative procedure. The results demonstrate that the positions of the peaks near Fermi energy are remarkably affected by the relative locations of pentagons. It is observed that in thin nanotubes, carbon atoms belonging two neighboring pentagon rings have significant contribution in the localized states near fermi energy. From our calculations, it turns out that the metallic or semiconducting behavior of capped nanotubes in the tip regions depends on the metallic or semiconducting nature of their nanotube stems. 相似文献
62.
We present the results of ab initio density functional theory calculations on the energetic, and geometric and electronic structure of Li-intercalated (6,6) silicon carbide nanotube (SiCNT) bundles. Our results show that intercalation of lithium leads to the significant changes in the geometrical structure. The most prominent effect of Li intercalation on the electronic band structure is a shift of the Fermi energy which occurs as a result of charge transfer from lithium to the SiCNTs. All the Li-intercalated (6,6) SiCNT bundles are predicted to be metallic representing a substantial change in electronic properties relative to the undoped bundle, which is a wide band gap semiconductor. Both inside of the nanotube and the interstitial space are susceptible for intercalation. The present calculations suggest that the SiCNT bundle is a promising candidate for the anode material in battery applications. 相似文献
63.
Mohammad Saeid Hosseini Somayeh Khorashahi Navid Hosseini 《Journal of fluorescence》2016,26(3):867-874
The CdSe quantum dots (QDs) capped with 2-mercaptonicotinic acid (H2MN) were prepared through a controllable process at 80 °C. The prepared QDs were characterized by XRD, TEM, IR, UV–Vis and fluorescence (FL) techniques. It was found that the QDs were nearly mono-disperse with the diameters in the range of 8–10 nm. These QDs are capable to exhibit strong FL even in concentrated acidic media. They exhibit an enhanced fluorescence in the presence of Cr(VI), which was used for the determination of Cr(VI) in water samples. The linear range was found to be 1?×?10?7–6.0?×?10?6 M with the RSD and DL of 0.92 % and 5?×?10?8 M, respectively. Except that Ca2+ and Fe3+ which can be eliminated through a simple precipitation process, the other co-existent ions present in natural water were not interfered. The recoveries obtained for the added amounts of Cr(VI) were in the range of 96.9–103.2 %, which denote on application of the method, satisfactorily. 相似文献
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65.
Rezaee Elham Amrolah Somayeh Minaei Nazari Maryam Tabatabai Sayyed Abbas 《Molecular diversity》2021,25(1):45-53
Molecular Diversity - Soluble epoxide hydrolase (sEH) enzyme plays an important role in the metabolism of endogenous chemical mediators, epoxyeicosatrienoic acids, which are involved in the... 相似文献
66.
Habib Firouzabadi Nasser Iranpoor Abbas Ali Jafari Somayeh Makarem 《Journal of molecular catalysis. A, Chemical》2006,250(1-2):237-242
AlPW12O40 as a recyclable Lewis acid and stable solid compound was introduced for efficient ring opening of different epoxides with thiols, acetic acid, and primary, secondary, and tertiary alcohols. These processes were carried out at room temperature with high regio- and stereoselectivity. 相似文献
67.
Somayeh Behrouz 《Journal of Saudi Chemical Society》2018,22(3):261-268
A facile and highly efficient one-pot three-component synthesis of 1-H-2-substituted benzimidazole derivatives from readily available substrates catalyzed by copper-doped silica cuprous sulfate (CDSCS) is described. In this method, treatment of diverse 2-bromoanilines, aldehydes, and [bmim]N3 in DMF at 110 °C in the presence of CDSCS as a highly efficient heterogeneous nano-catalyst affords the corresponding 1-H-2-substituted benzimidazoles in good to excellent yields. The CDSCS is an inexpensive and stable nano-catalyst that could be simply prepared, recovered and reused for many consecutive reaction runs without significant loss of its activity. 相似文献
68.
Mohammad Mazloum Ardakani Parvaneh Rahimi Hossein Dehghani Payam Ebrahimi Karami Hamid Reza Zare Somayeh Karami 《Electroanalysis》2007,19(21):2258-2263
The preparation and electrocatalytic behavior of glassy carbon electrodes modified with three different cobalt porphyrin complexes were investigated. The electrocatalytic ability of the modified electrodes for the reduction of dioxygen to hydrogen peroxide and water in air‐saturated aqueous solutions was examined by cyclic voltammetry and chronoamperometry techniques. The porphyrin‐adsorbed glassy carbon electrodes possess excellent electrocatalytic abilities for dioxygen reduction with overpotential about 0.5 V lower than that at a plain glassy carbon electrode. The experimental parameters were optimized and the mechanism of the catalytic process was discussed. The possible effects of the electron‐donating properties of groups in the meso‐position of the porphyrin ring were investigated. 相似文献
69.
Somayeh Ahadi 《Tetrahedron》2009,65(45):9316-9321
The synthesis of spiro[benzo[h]pyrazolo[3,4-b][1,6]naphthyridine-7,3′-indoline]-2′,6(5H)-diones and spiro[chromeno[4,3-b]pyrazolo[4,3-e]pyridine-7,3′-indoline]-2′,6(6aH,10H)-diones via a one-pot, three-component reaction of 4-hydroxycoumarin or 4-hydroxy-1-methylquinolin-2(1H)-one, isatins and 1H-pyrazol-5-amines in water is reported. 相似文献
70.
Synthesis of Pyrimidinone and 5‐unsubstituted 4, 6‐diarylpyrimidine‐2(1H)‐ones by Using Nano Magnetic Catalyst under Solvent Free Condition 下载免费PDF全文
Nano magnetic‐supported sulfonic acid is found to be a powerful and reusable heterogeneous catalyst for the efficient synthesis of pyrimidinones. In this study we use various ketones such as acetophenone and cyclopentanone instead of β‐keto ester in one‐pot synthesis of pyrimidinone at biginelli like reaction. Our objective is to improve conditions for the synthesis of multicomponent reactions using nano magnetic catalyst under solvent free condition. A number of excellent and significant results have been developed that lead our perspective understanding the effect of the magnetic nanoparticles when they are used as catalysts. 相似文献