Robust multilevel methods for quadratic finite element anisotropic elliptic problems

This paper discusses a class of multilevel preconditioners based on approximate block factorization for conforming finite element methods employing quadratic trial and test functions. The main focus is on diffusion problems governed by a scalar elliptic partial differential equation with a strongly anisotropic coefficient tensor. The proposed method provides a high robustness with respect to non‐grid‐aligned anisotropy, which is achieved by the interaction of the following components: (i) an additive Schur complement approximation to construct the coarse‐grid operator; (ii) a global block (Jacobi or Gauss–Seidel) smoother complementing the coarse‐grid correction based on (i); and (iii) utilization of an augmented coarse grid, which enhances the efficiency of the interplay between (i) and (ii). The performed analysis indicates the high robustness of the resulting two‐level method. Moreover, numerical tests with a nonlinear algebraic multilevel iteration method demonstrate that the presented two‐level method can be applied successfully in the recursive construction of uniform multilevel preconditioners of optimal or nearly optimal order of computational complexity. Copyright © 2013 John Wiley & Sons, Ltd.     

Quantitative determination of sodium stearyl fumarate in a tablet formulation from continuous manufacturing using a high-pH reversed-phase HPLC method

This study demonstrates the first use of a reversed-phase (RP) high-performance liquid chromatography method with a high-pH buffer for the analysis of sodium stearyl fumarate (SSF) from a tablet formulation. After examining the retention time and peak shape using various buffer concentrations, buffer pH, and RP stationary phases, an optimized method was established using the XBridge® BEH C18 at high pH. This column was further evaluated for method specificity, accuracy, precision, linearity, stability, and sensitivity. Finally, the method was successfully used as a convenient and robust analytical procedure to accurately quantitate SSF in stratified tablets from a continuous manufacturing process to confirm the excipient uniformity throughout the process.     

大型公共建筑工程质量保险纯费率厘定研究——基于GLM及GAM的实证比较分析

为准确地厘定大型公共建筑工程质量的保险纯费率，通过文献分析及调研，对影响大型公共建筑工程质量的因素进行了研究，提炼出11项保险费率因子。以46栋竣工于1993—2016年的大型公共建筑为工程数据集，在频率-强度法基础上，基于Poisson、Negative Binomial、Gamma、Inverse Gauss等分布的假设，利用广义线性模型及广义可加模型建立了8个工程质量保险纯费率厘定模型，通过比较选择最优模型，并对模型进行了验证。结果表明，所建模型可用于大型公共建筑工程质量保险纯费率厘定。     

Hypercoal对不同炼焦煤炭化改质作用的显微镜研究

Hypercoal(HPC)被作为一种添加剂加入到两种性质不同的炼焦煤中,以探讨其对炼焦煤炭化的改质作用。通过偏光显微镜以及扫描电镜观测炭化产物的组织结构变化。结果表明,添加剂的用量以及粒径对炼焦煤炭化改质作用的大小与原料煤的煤质有关,对焦煤改质时要求添加剂颗粒的粒径较大;而对弱黏结性煤改质时,添加剂粒径较小且添加量较多更有利于黏结和熔融作用。通过添加HPC可改善焦煤因过度膨胀造成的不均匀孔隙结构,而且孔的数量与孔径减小,孔壁增厚;添加剂在炭化过程中产生的胶质体促进了弱黏结性煤的黏结和熔融,改善了炭化产物的结构。实验还考察了原料中水分、成型压力等因素对炭化产物结构的影响。结果表明,煤中水分会在炭化产物中产生特殊的孔隙结构,而成型压力对炭化改质作用则因原料煤质不同而不同。     

High‐efficiency polymer solar cells based on phenylenevinylene copolymer with BF2‐azopyrrole complex and CN‐PC70BM with solvent additive

Power conversion efficiency (PCE) of phenylenevinylene‐based copolymer with BF₂ azopyrrole complex (PB)/modified PC₇₀BM, that is, CN‐PC₇₀BM bulk heterojunction solar cells improves from 2.16 to 4.90% using a processing additive and drying condition. The results demonstrate that a processing additive and drying condition provides an effective means to control both the surface roughness and finer interpenetrating networks to enhance the exciton dissociation into free charge carriers, charge transportation, and collection. Taking into the account of simple device fabrication process without thermal annealing, the PCE of the polymer solar cell can further improved by chloronapthalene (CN) additive under the fast drying condition. The average carrier lifetimes extracted from the impedance spectra and found to correlate with measured PCEs. At short circuit conditions and illumination, the average charge carrier lifetime was found vary from 16.8 to 32 μs with power conversion efficiencies ranging from 3.0 to 4.9%. © 2012 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys, 2012     

A hierarchical porous carbon membrane from polyacrylonitrile/polyvinylpyrrolidone blending membranes: Preparation,characterization and electrochemical capacitive performance

Novel hierarchical porous carbon membranes were fabricated through a simple carbonization procedure of well-defined blending polymer membrane precursors containing the source of carbon polyacrylonitrile (PAN) and an additive of polyvinylpyrrolidone (PVP), which was prepared using phase inversion method. The as-fabricated materials were further used as the active electrode materials for supercapacitors. The effects of PVP concentration in the casting solution on structure feature and electrochemical capacitive performance of the as-prepared carbon membranes were also studied in detail. As the electrode material for supercapacitor, a high specific capacitance of 278.0 F/g could be attained at a current of 5 mA/cm² and about 92.90% capacity retention could be maintained after 2000 charge/discharge cycles in 2 mol/L KOH solution with a PVP concentration of 0.3 wt% in the casting solution. The facile hierarchical pore structure preparation method and the good electrochemical capacitive performance make the prepared carbon membrane particularly promising for use in supercapacitor.     

Effect of additive length and chemistry on the morphology of blends of conjugated thiophenes and fullerene derivative acceptor molecules

Small molecule additives have been shown to increase the device efficiency of conjugated polymer (donor) and fullerene derivative (acceptor) based organic solar cells by modifying the morphology of the device active layer. In this paper we conduct a systematic study of how additives affect the donor‐acceptor morphology using molecular dynamics simulations of blends of thiophene‐based oligomers, mimicking poly(3‐dodecylthiophene) (P3DDT) or poly(2,2′:5′,2”‐3,3”‐didocyl‐terthiophene) (PTTT), and fullerene derivatives with additives of varying length and chemical functionalization, mimicking experimentally used additives like methyl ester additives, diiodooctane, and alkanedithiols. We find that functionalization of additives with end groups that are attracted to acceptor molecules are necessary to induce increased donor‐acceptor macrophase separation. In blends where acceptors intercalate between oligomer alkyl side chains, functionalized additives decrease acceptor intercalation. Functionalized additives with shorter alkyl segments increase acceptor macrophase separation more than additives with same chemical functionalization but longer alkyl segments. © 2015 Wiley Periodicals, Inc. J. Polym. Sci., Part B: Polym. Phys. 2015 , 53, 1046–1057     

基于拓扑优化和深度学习的新型结构生成方法

计算机辅助设计已广泛应用于结构计算和分析,但如何利用计算机智能生成最佳的新型结构还面临巨大挑战。针对这一问题,提出了一种基于拓扑优化和深度学习的新型结构智能生成方法。该方法首先通过结构拓扑优化分析获得不同参数下的优化结果制作训练集图片,并将训练集标签定义为相应的工况类型,然后应用最小二乘生成对抗网络(LSGAN)深度学习算法进行训练并生成大量的新型结构,最后建立评价指标和评估体系对生成的模型进行评价比较,根据需求选择最佳结构设计方案。结合一个铸钢支座节点底板设计的工程案例,详细阐述了上述方法的应用过程,并借助三维重构技术和增材制造技术实现结构模型的一体化制造。研究结果表明,基于拓扑优化和深度学习的新型结构智能生成方法不仅可以自动生成新的结构,而且可以进一步优化结构的材料用量和力学性能。     

油溶性二正辛基二硫代氨基甲酸铈的合成及其摩擦化学特性研究

以二正辛胺、Ｃｅ２Ｏ３和ＣＳ２为原料合成出一种新型油溶性润滑油极压抗磨添加剂二正辛基二硫代氨基甲酸铈（Ⅲ），并在环－块式摩擦磨损试验机和四球试验机上，测定了它的减摩性能、承载能力和抗磨性能等，同时还就其添加量对这些性能的影响进行了考察；利用俄歇电子能谱仪和Ｘ射线光电子能谱仪，对边界润滑状态下形成的摩擦表面膜的元素组成和化学状态进行了分析．结果表明：在给定的试验条件下，这种添加剂可以使ＩＳＯＶＧ３２石蜡基矿物油的摩擦系数明显降低，能够使这种油的初始卡咬负荷和烧结负荷分别提高２．２倍和４．７倍，可见其减摩和抗磨性能良好；在这种添加剂作用下形成的表面层内含有有机物膜、氧化物膜、化学反应膜和Ｃｅ３＋渗透层等，这是摩擦化学作用的产物