贵金属钌基催化剂合成及应用研究进展

钌催化剂是近年来新兴的贵金属催化剂,其负载型催化剂具有节约成本、可回收利用、催化性能优异等优势,受到研究人员的广泛关注。本文对负载型钌基催化剂在氨合成反应、加氢反应、氧化反应的合成及应用进行了综述,主要阐述了反应过程中的载体与助剂、制备方法和催化性能,并对当前反应中存在的问题进行归纳和总结,最后提出负载型钌基催化剂现阶段亟需解决的问题以及对未来的主要发展趋势进行了展望。     

An Electrocardiogram Signal Classification Algorithm Based on Improved Deep Residual Shrinkage Networks北大核心CSCD

心电信号分类是医疗保健领域的重要研究内容.针对大多数方法不能很好地降低样本数量少的类别漏诊率,以及降低预处理操作的复杂性问题,提出了一种基于改进深度残差收缩网络(IDRSN)的心电信号分类算法(即DRSL算法).首先,使用合成少数类过采样技术(SMOTE)扩充数量少的类别样本,从而解决了类不平衡问题;其次,利用改进深度残差收缩网络提取空间特征,其残差模块可以避免网络层加深造成的过拟合,压缩激励和软阈值化子网络可以提取重要局部特征并自动去除噪声;然后,通过长短期记忆网络(LSTM)提取时间特征;最后,利用全连接网络输出分类结果.在MIT-BIH心律失常数据集上的实验结果表明,该算法的分类性能优于IDRSN、DRSN、GAN+2DCNN、CNN+LSTM_ATTENTION、SE-CNN-LSTM分类算法.     

Thermal Buckling Analysis of FGM Sandwich Circular Plates Under Transverse Nonuniform Temperature Field Actions北大核心CSCD

Based on the von Kármán geometric nonlinear plate theory, the displacement⁃type geometric nonlinear governing equations for FGM sandwich circular plates under transverse nonlinear temperature field actions were derived. With the immovable clamped boundary condition, the analytical formula for dimensional critical buckling temperature differences of the system was obtained from the solution of the linear eigenvalue problem. Moreover, the 2⁃point boundary value problem of ordinary differential equations was solved with the shooting method. The effects of geometric parameters, constituent material properties, gradient indexes, temperature field parameters and layer⁃thickness ratios on the critical buckling temperature differences, the thermal postbuckling equilibrium paths, and the buckling equilibrium configurations of FGM sandwich circular plates, were investigated. The results show that, with the increases of the thickness⁃radius ratio, the relative thickness of the FGM layer and the gradient index, the FGM sandwich circular plate's critical buckling temperature difference will increase monotonically. Given a fixed radius and a fixed total thickness, the postbuckling deformation of the FGM sandwich circular plate will decrease significantly with the relative thickness of the FGM layer. © 2023 Editorial Office of Applied Mathematics and Mechanics. All rights reserved.     

镍基合金掺杂W、Mo原子在γ/γ＇相界面扩散机理研究

运用基于密度泛函理论的第一性原理,研究掺杂W、Mo在镍基高温合金的沉淀强化γ′相分配差异的因素.通过VASP软件,建立γ′-Ni₃(Al_3/8Ti_5/8)相的体系模型,选取非等效位置的不同阵点,计算W、Mo原子在不同位置的替代形成能,分析W、Mo在γ′相的占位倾向;计算掺杂W、Mo原子前后,界面的吸附能,研究掺杂W、Mo对相界的影响;计算W、Mo原子从γ向γ′相扩散,获得W、Mo扩散的路径与势垒.结果表明,W、Mo的掺杂优先替代γ′-Ni₃(Al_3/8Ti_5/8)相5号Al原子,并提高相界的稳定性;分配的差异是W相比于Mo替代γ′相位置的Al原子更易形成空位,而γ相中的Ni原子较难形成空位,且逆扩散所需能量更多导致的.     

十三陵抽水蓄能电站上池西外坡岩体稳定分析

上池西外坡岩体稳定是十三陵抽水蓄能电站主要的地质工程问题之一，由于受到倾向池外的数条缓倾角断层以及不良的岩体结构控制，存在着滑动位移、变形失稳的可能性，电站的安全运行受到潜在的威胁。因此对西外坡岩体进行稳定分析，并进行补强处理是必要的。     

用白光相对客观散斑技术实测海冰力学性质的初探

本文提出了一种改进的白光散技术，应用此技术测量了单轴压缩下海冰的弹性模量，实测结果与电测法的结果符合程度良好，本文方法操作简单，避免了海水的表面缺隐和浸反射条件差以及表面升华等因素对测量的影响。     

二维正态分布函数值的一个近似算法

二维正态分布函数值的计算是估算串联结构体系失效概率上、下限的一项重要内容。目前一般常采用两种方法，即数值积分和界限法。前者因计算量大，耗时多不便实用，后者使结构体系失效率的上、下界限进一步变宽。本文给出一个计算二维正态分布函数值的近似方法。实际计算表明，本方法计算效率高，精度完全能满足工程应用要求     

RESISTANCE EFFECT OF ELECTRIC DOUBLE LAYER ON LIQUID FLOW IN MICROCHANNEL

Poisson-Boltzrnann equation for EDL (electric double layer) and Navier-Stokes equation for liquid flows were numerically solved to investigate resistance effect of electric double layer on liquid flow in microchannel. The dimension analysis indicates that the resistance effect of electric double layer can be estimated by an electric resistance number, which is proportional to the square of the liquid dielectric constant and the solid surface zeta potential, and inverse-proportional to the liquid dynamic viscosity, electric conductivity and the square of the channel width. An "electric current density balancing" (ECDB) condition was proposed to evaluate the flow-induced streaming potential, instead of conventional "electric current balancing" (ECB) condition which may induce spurious local backflow in neighborhood of the solid wall of the microchannel. The numerical results of the flow rate loss ratio and velocity profile are also given to demonstrate the resistance effect of electric double layer in microchannel.     

A DFT study of cage compounds: 3, 5, 8, 10, 11, 12-hexanitro-3, 5, 8, 10, 11, 12-hexaazatetracyclo [5.5.1.12,6.04,9] dodecane and its derivatives as high energetic materials

A new cage compound, 3, 5, 8, 10, 11, 12-hexanitro-3, 5, 8, 10, 11, 12-hexaazatetracyclo [5.5.1.1^2,6.0^4,9] dodecane (HNHATCD, I) as well as its –ONO₂ (II) and –N₃ (III) derivatives were proposed in the present work. Their molecular structures were optimized at the B3LYP/6-31G(d,p) level of density functional theory. Heat of formation, strain energy, detonation performance, and thermal stability were studied. Results show that the –N₃ group greatly increases the heat of formation, but decreases the strain energy and density, and it is much more helpful for enhancing the detonation energy than the –NO₂ and –ONO₂ groups. An analysis of bond dissociation energies (BDEs) of the weakest bonds implies that the BDE of –N₃ derivatives is the smallest but it is still larger than 120 kJ mol^?1, revealing that these designed compounds have a high thermal stability. Considering the detonation performance and thermal stability, I and II may be potential candidates of high energy density materials.