Hybrid luminescent films obtained by covalent anchoring terbium complex to silica-based network

New monomer N-(4-carboxyphenyl)-NL-(propyltriethoxysilyl)urea (1) which acts as both a ligand for Th3+ ion and a sol-gel precursor has been synthesized and characterized by H-1 NMR, and MS. Hybrid luminescent thin films consisting of organoterbium covalently bonded to a silica-based network have been obtained in situ via a sol-gel approach. Strong line emission of Tb3+ ion was observed from the hybrid luminescent films under UV excitation.

Robust Learning Control for Manipulators with Uncertainty Disturbances Based on Internal Model

In this paper, a disturbance controller is designed for making robotic system behave as a decoupled linear system according to the concept of internal model. Based on the linear system, the paper presents an iterative learning control algorithm to robotic manipulators. A sufficient condition for convergence is provided. The selection of parameter values of the algorithm is simple and easy to meet the convergence condition. The simulation results demonstrate the effectiveness of the algorithm..

An in silico approach for screening flavonoids as P-glycoprotein inhibitors based on a Bayesian-regularized neural network

P-glycoprotein (P-gp), an ATP-binding cassette (ABC) transporter, functions as a biological barrier by extruding cytotoxic agents out of cells, resulting in an obstacle in chemotherapeutic treatment of cancer. In order to aid in the development of potential P-gp inhibitors, we constructed a quantitative structure-activity relationship (QSAR) model of flavonoids as P-gp inhibitors based on Bayesian-regularized neural network (BRNN). A dataset of 57 flavonoids collected from a literature binding to the C-terminal nucleotide-binding domain of mouse P-gp was compiled. The predictive ability of the model was assessed using a test set that was independent of the training set, which showed a standard error of prediction of 0.146 +/- 0.006 (data scaled from 0 to 1). Meanwhile, two other mathematical tools, back-propagation neural network (BPNN) and partial least squares (PLS) were also attempted to build QSAR models. The BRNN provided slightly better results for the test set compared to BPNN, but the difference was not significant according to F-statistic at p = 0.05. The PLS failed to build a reliable model in the present study. Our study indicates that the BRNN-based in silico model has good potential in facilitating the prediction of P-gp flavonoid inhibitors and might be applied in further drug design.

Interface energy and its influence on interface fracture between metal and ceramic thin films in nanoscale

A theoretical model about the size-dependent interface energy between two thin films with different materials is developed by considering the chemical bonding contribution based on the thermodynamic expressions and the structure strain contribution based on the mechanical characteristics. The interface energy decreases with reducing thickness of thin films, and is determined by such available thermodynamic and mechanical parameters as the melting entropy, the melting enthalpy, the shear modulus of two materials, etc. The predicted interface energies of some metal/MgO and metal/Al2O3 interfaces based on the model are consistent with the results based on the molecular mechanics calculation. Furthermore, the interface fracture properties of Ag/MgO and Ni/Al2O3 based on the atomistic simulation are further compared with each other. The fracture strength and the toughness of the interface with the smaller structure interface energy are both found to be lower. The intrinsic relations among the interface energy, the interface strength, and the fracture toughness are discussed by introducing the related interface potential and the interface stress. The microscopic interface fracture toughness is found to equal the structure interface energy in nanoscale, and the microscopic fracture strength is proportional to the fracture toughness. (C) 2010 American Institute of Physics. [doi:10.1063/1.3501090]

Luminescent hybrid films obtained by covalent grafting of terbium complex to silica network

Luminescent hybrid thin films consisting of terbium complex covalently bonded to a silica-based network have been obtained in situ via a sol-gel approach. A new monomer, N-(4-benzoic acid-yl), N'-(propylthiethoxysilyl)urea (PABI), has been synthesized by grafting isocyanatopropyltriethoxysilane (ICPTES) to p-aminobenzoic acid and characterized by H-1 NMR IR and MS, The monomer acts as a ligand for Tb3+ ion and as a sol-gel precursor. Band emission front Tb3+ ion due to an efficient ligand-to-metal energy transfer was observed by UV excitation. The decay curves of Tb3+ in the hybrid films were measured. The energy difference between the triplet state energy of PABI and the D-5(4) level of Tb3+ ion falls in the exciting range to sensitize Tb3+ ion fluorescence.

基于神经网络的激光熔覆高度预测

激光成形过程中,对熔覆高度进行实时检测,从而实现熔覆高度闭环控制是成形高质量零件的保证。激光成形过程是一个多参数耦合的非线性过程,大量激光参数对成形熔覆表面质量具有重要影响。在分析激光参数对熔覆高度影响的基础上,建立利用激光工艺参数预测熔覆高度的误差反向传播(Backpropagation,BP)神经网络模型,完成了网络算法设计。通过激光成形试验采集样本,利用训练样本对所建立的网络进行训练,完成网络输入输出高度映射关系,并利用测试样本对所训练的网络进行检验。仿真试验表明,神经网络熔覆高度预测模型具有很高的精度,验证了该预测模型在理论和实践上的可行性与有效性。神经网络熔覆高度预测模型为实现激光加工过程熔覆高度实时预测与闭环控制打下基础,对提高成形产品质量具有重要意义。

松辽徐家围子断陷层序地层充填模式及含油气性特征

Based on the principle and method of sequence, the author describes the sequence-filling model of the rifting basin of Xujiaweizi and its gas exploration potential. The object of this paper belongs to the area around Shengping-Wangjiatun anticline. Its srtatigraphy includes Huoshiling Formation (neutral and basic volcanic rocks), Shahezi Formation (coal bedding and mud and some sandstone) and Yingcheng Formation from bottom to top. These stratigraphy units are defined by author as mesosequences respectively. The author emphasizes that the main control factors of sequence change with the types of basin and stage of basin. So the sequence is researched according to the types of basin. This viewpoint is very new, and it is consistent with the principle of sequence. Volcanic action is very frequent and acute, topography difference is obvious. Between the volcanic events, Shahezi Formation is formed, which mainly consists-of sedimentary rocks. Based on the datum from seismic section and drilling core and well-logging, the author analyzes the single unit and unit set and system tract and sedimentary fancies, then, according to the accommodation space change and marking of sequence boundary, Shahezi Formation is divided into two Third-scale sequences. The sedimentary fancies and depth distribution are described. The author also pointed out that the volcanic rocks consume the accommodation space, so volcanic rocks can influence the development of sequence. Based on the concept of accommodation space, the author put volcanic rocks into sequence frame, which normally consists of sedimentary rocks. The topography of volcanic is controlled by lithology of volcanic rocks, the pattern of volcanic eruption and the topography before volcanic eruption. The topography of volcanic can influence sedimentation and the filling pattern of sedimentary rocks. The author describes the composition and lithology fancies and depth distribution of volcanic rocks. The volcanic rocks and Volcanic building, volcanic structure is recognized on seismic section. The author paid a special attention to the relationship between sedimentation and volcanism. Finally, the author analyses the combination of source-reservoir-cover unit in sequence frame. The mudstone of Shahezi Formation has a great depth, the Kerogene in it belongs to type II and III, which tends to produce gas. The Yingcheng Formation lies between Shahezi Formation and Denglouku Formation, belonging to good reservoir. The volcanic rocks of Huoshiling Formation often formed high building, which can capture the gas produced from Shahezi Formation. The stratigraphy of rifting basin of Xujiaweizi has the great potential of gas exploration. This paper claims the following creative points: 1. The author applied the principle and method of sequence to rifting basin, greatly extending its research area and topic issues. 2. The author pointed out that basin of different type and of different stage has a different type of sequence. This is caused by the different main control factors of sequence. 3. Put volcanic rocks into the sequence frame, discussing the probability of regarding the volcanic rocks as the component of sequence, dealing with the relationship between sedimentation and volcanism and its influence to the source-reservoir-cover system. 4. The author pointed out that the filling pattern of rifting basin are determined by the filling pattern of megasequence, whose filling pattern is determined by the filling pattern of system tract and the change of accommodation space.

Comparisons of static, quasi-static and dynamic 3D porous media scale network models for two-phase immiscible flow in porous media

A dynamic 3D pore-scale network model is formulated for investigating the effect of interfacial tension and oil-water viscosity during chemical flooding. The model takes into account both viscous and capillary forces in analyzing the impact of chemical properties on flow behavior or displacement configuration, while the static model with conventional invasion percolation algorithm incorporates the capillary pressure only. From comparisons of simulation results from these models. it indicates that the static pore scale network model can be used successfully when the capillary number is low. With the capillary increases due to the enhancement of water viscosity or decrease of interfacial tension, only the quasi-static and dynamic model can give insight into the displacement mechanisms.

New Strain Gradient Theory And Analysis

A new strain gradient theory which is based on energy nonlocal model is proposed in this paper, and the theory is applied to investigate the size effects in thin metallic wire torsion, ultra-thin beam bending and micro-indentation of polycrystalline copper. First, an energy nonlocal model is suggested. Second, based on the model, a new strain gradient theory is derived. Third, the new theory is applied to analyze three representative experiments.

Dynamics of femtosecond laser pulse induced damage in multilayers

We report the single-shot damage thresholds of MgF2/ZnS onmidirectional reflector for laser pulse durations from 50 A to 900 fs. A coupled dynamic model is applied to study the damage mechanisms, in which we consider not only the electronic excitation of the material, but also the influence of this excitation-induced changes in the complex refractive index of material on the laser pulse itself. The results indicate that this feedback effect plays a very important role during the damage of material. Based on this model, we calculate the threshold fluences and the time-resolved excitation process of the multiplayer. The theoretical calculations agree well with our experimental results. (c) 2005 Elsevier B.V. All rights reserved.

Effect of recording conditions on the anisotropic diffraction of volume holographic gratings

The anisotropic Bragg diffraction of the volume holographic gratings in photorefractive crystals are investigated based on the model of anisotropic coupled-wave theory. The effect of the initial intensity ratio and the recording angles of the two recording waves on the anisotropic Bragg diffraction properties is discussed. It is shown that both the ratio of the initial intensity and the incident angles of the recording waves are selective action for the anisotropic Bragg diffraction efficiency of the volume holographic gratings, while these two recording conditions are not selective action for the isotropic Bragg diffraction. Furthermore, the Bragg phase matching condition of anisotropic diffraction is analyzed when the recording angles change. (C) 2006 Elsevier GmbH. All rights reserved.

Offner展宽器曲面镜误差对输出脉冲对比度的影响

在ffner展宽器的设计研究中,对曲面镜曲率半径的误差研究非常重要,它直接影响输出脉冲的质量。因此有必要分析ffner展宽器中曲面镜曲率半径的误差对输出脉冲对比度的影响。参考ffner展宽器的光线追迹模型,建立了ffner展宽器中曲面镜曲率半径存在误差时的光线追迹模型;根据建立的模型,详细分析了曲面镜曲率半径的误差对输出脉冲质量的影响;发现在目前曲面镜曲率半径的加工误差在0.2%~0.5%的情况下,完全可以满足神光II拍瓦激光装置中对展宽器的要求;同时发现如果曲面镜曲率半径存在误差时,应该尽量使两曲面镜之间的距离保持为凹面反射镜曲率半径的一半,而不是使两曲面镜保持同心。