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131.
Hui-Li Li  Ying Li  Mei-Ling Duan 《Molecular physics》2013,111(21-23):2643-2648
The octahedral (FeO6)9? and tetrahedral (FeO4)5? clusters in yttrium gallium garnet (YGG): Fe3+ system are investigated based on the 252 × 252 complete energy matrices for d5 configuration ions in trigonal and tetragonal ligand fields, moreover, the EPR and optical spectra are made unified calculation. The results indicate that the defect structures around Fe3+ centres display expansion effects at different temperatures 4.2 and 295 K, and which are close to those in YIG garnet, respectively. Simultaneously, the defect structure parameters for Fe3+ centres in YGG are determined, and the relationship between the defect structure and the temperature has been discussed.  相似文献   
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We present a new approach to calculate analytic approximations of blow‐up solutions and their critical blow‐up times. Our approach applies the Adomian decomposition–Padé method to quickly and easily compute the critical blow‐up times, which comprises the Adomian decomposition method combined with the Padé approximants technique. We validate our new approach with a variety of numerical examples, including nonlinear ODEs, systems of nonlinear ODEs, and nonlinear PDEs. Furthermore, our new method is shown to be more convenient than prior art that relies on compound discretized algorithms. Copyright © 2013 John Wiley & Sons, Ltd.  相似文献   
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Recently,various efforts have been put forward on the development of technologies for the synthesis of methane from CO2 and H2,since it can offer a solution for renewable H2 storage and transportation.In parallel,this reaction is considered to be a critical step in reclaiming oxygen within a closed cycle.Over the years,extensive fundamental research works on CO2 methanation have been investigated and reported in the literatures.In this updated review,we present a comprehensive overview of recent publications during the last 3 years.Various aspects on this reaction system are described in detail,such as thermodynamic considerations,catalyst innovations,the influence of reaction conditions,overall catalytic performance,and reaction mechanism.Finally,the future development of CO2 methanation is discussed.  相似文献   
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<正>Two new terpenes,wilfornine H(1) and triptobenzene Q(2) were isolated from Tripterygium wilfordii,as well as 11 terpenes. Their structures were elucidated by spectroscopic methods.Compounds 5,9-13 showed significant immunosuppressive activities.  相似文献   
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Ventral and rostral regions of the brain are of emerging importance for the MRI characterization of early dementia, traumatic brain injury and epilepsy. Unfortunately, standard single-shot echo planar diffusion-weighted imaging of these regions at high fields is contaminated by severe imaging artifacts in the vicinity of air–tissue interfaces. To mitigate these artifacts and improve visualization of the temporal and frontal lobes at 7 T, we applied a reduced field-of-view strategy, enabled by outer volume suppression (OVS) with novel quadratic phase radiofrequency (RF) pulses, combined with partial Fourier and parallel imaging methods. The new acquisition greatly reduced the level of artifacts in six human subjects (including four patients with early symptoms of dementia).  相似文献   
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Three novel coordination polymers, [Co(NH2-Aip)(H2Bibim)] n (1), [Co(NH2-Aip)(HBibimop)] n  √ nH2O (2) and [Mn(NH2-Aip) √ H2O] n  √ 2nH2O (3) with NH2-Aip and similar benzimidazole derivative ligands (NH2-Aip = 5-aminoisophthalic acid, H2Bibim = 2,2′-bibenzimidazole and HBibimop = 1,3-bis(benzimidazol-2-yl)-2-oxapropane), have been synthesised under hydrothermal conditions and structurally characterised by single-crystal X-ray diffraction analysis, elemental analysis and IR spectroscopy. 5-Aminoisophthalic acid ligand adopts μ2-, μ3- and μ4-bridge coordination fashion and benzimidazole derivatives exist as terminal- and bridge-mode in complexes 13. The intricate hydrogen bonds and π–π stacking interactions in supramolecular framework are discussed. Using the combination of ultraviolet–visible absorption titration and fluorescence spectra, the experimental results show that complexes 1 and 2 bind to DNA in an intercalative mode and their DNA-binding constants (K b ) are also found.  相似文献   
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