Synergistic effect of co-alloying elements on site preferences and elastic properties of Ni3Al: A first-principles study

The site preferences of co-alloying elements (Mo–Ta, Mo–Re, Mo–Cr) in Ni₃Al are studied using first-principles calculations, and the effects of these alloying elements on the elastic properties of Ni₃Al are evaluated by elastic property calculations. The results show that the Mo–Ta, Mo–Re and Mo–Cr atom pairs all prefer Al–Al sites and the spatial neighbor relation of substitution sites almost has no influence on the site preference results. Furthermore, the Young's modulus of Ni₃Al increases much higher by substituting Al–Al sites with co-alloying atoms, among which Mo–Re has the best strengthening effect. The enhanced chemical bondings between alloying atoms and their neighbor host atoms are considered to be the main strengthening mechanism of the alloying elements in Ni₃Al.     

Discovery of Affinity-Based Probes for Btk Occupancy Assays

Bruton's tyrosine kinase (Btk) is an attractive target for the treatment of a wide array of B-cell malignancies and autoimmune diseases. Small-molecule covalent irreversible Btk inhibitors targeting Cys481 have been developed for the treatment of such diseases. In clinical trials, probe molecules are required in occupancy studies to measure the level of engagement of the protein by these covalent irreversible inhibitors. The result of this pharmacodynamic (PD) activity provides guidance for appropriate dosage selection to optimize inhibition of the drug target and correlation of target inhibition with disease treatment efficacy. This information is crucial for successful evaluation of drug candidates in clinical trials. Based on the pyridine carboxamide scaffold of a novel solvent-accessible pocket (SAP) series of covalent irreversible Btk inhibitors, we successfully developed a potent and selective affinity-based biotinylated probe 12 (2-[(4-{4-[5-(1-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-3,6,9,12-tetraoxapentadecan-15-amido)pentanoyl]piperazine-1-carbonyl}phenyl)amino]-6-[1-(prop-2-enoyl)piperidin-4-yl]pyridine-3-carboxamide). Compound 12 has been used in Btk occupancy assays for preclinical studies to determine the therapeutic efficacy of Btk inhibition in two mouse lupus models driven by TLR7 activation and type I interferon.     

基于支持向量机的缓存预估模型的设计与实现

采用支持向量机(SVM)对网络业务流数据进行预测估计，通过训练样本，从而获得样本以外数据的分布规律。在此基础上，设计了一种网络排队队列缓存的预估模型。实验表明，该模型具有较高的训练效率和很高的估计精确度。     

M型四能级原子与三模场相互作用系统的动力学特性

采用全量子理论,研究了M型四能级原子与三模场相互作用系统的动力学特性,通过数值计算,分析了光场失谐量、初始光子数和原子初始状态对原子布居概率和光子统计演化规律的影响.     

用攀枝花钛矿和云南钛矿冶炼钛渣工业试验研究

通过磁性测量和X-射线衍射研究了Gd2(Co，Al)17化合物的结构和磁晶各向异性。当x≤4时，样品具有菱方Th2znl7型结构，x=5时，具有六方CaCu5型结构。随着Al浓度增加，晶格常数和单胞体积单调增大，而居里温度和自发磁化强度近似线性地减小；在x≥l时，观察到Co亚点阵的磁晶各向异性变号，室温易磁化方向由易面转变为易轴，且易轴各向异性场和各向异性常数随Al原子浓度增加出现极大值；基于补偿温度(65K)下自由粉末颗粒的磁化曲线，导出了亚点阵间的分子场系数和Gd-co交换耦合常数，结果表明，Al原子对Gd-Co交换耦合作用的影响较小。根据Al原子在Co亚点阵4种晶位的择优占位，分析了磁晶各向异性的演变。     

泰安天地广场游人行为研究

作为泰山西路登山之始的泰安天地广场,具有游客集散、市民游憩休闲、泰山文化展示等职能.利用实地观察、抽样调查问卷及访谈等研究方法,对广场游人使用状况进行了评价,并针对问题提出了相应的改进性建议.     

TD-LTE候选频段频谱分析系统的设计与实现

针对时分长期演进系统部署资源紧张的问题,设计一种时分长期演进候选频段分析系统。通过对四个典型城市(西安、北京、南京、上海)的频谱使用情况进行测量,将测量数据建立数据库,借助GIS软件将测量数据以频谱地图的形式进行展示,同时通过程序计算出各个频段的频谱占用度,并在特高频等频段中查找可利用的空闲频谱资源从而判断其是否能够部署时分长期演进系统。最后以西安为例进行了运算分析,结果表明,在西安市郊区698⁸06MHz存在一定空闲频段能够部署时分长期演进系统。     

Solid-solution hardening and softening by Fe additions to NiAl

Solid-solution hardening in the case of a ternary alloy addition to a B2 compound with the triple defect structure has been investigated. The fact that the ternary element may occupy either of two sublattices or may affect the concentration of other types of point defects present in the material makes this a very interesting problem to consider. Ni-rich (40 at% Al), stoichiometric (50 at% Al), and Al-rich (52 at% Al) alloys were doped with up to 12 at% Fe. Lattice parameter, bulk density and hardness measurements were performed on samples quenched from 1000 °C. It was found that solid-solution softening actually occurs in the Ni-rich alloys, while hardening was observed in the stoichiometric and Al-rich alloys. The vacancy concentration was determined from the experimental data, and the site occupancies of the Fe atoms were estimated from a thermodynamic model. Through careful consideration of all point defect concentrations the solid-solution hardening and softening behaviors could be effectively rationalized.     

基于实时路况的交通信号灯智能管控方法

为解决城市严重的交通拥堵问题,提出一种基于实时路况的交通信号灯智能管控方法。实时检测交叉方向车辆,计算车道占用率,应用模糊控制理论优化信号灯切换频率,确保双向车道均衡使用。实验利用实测数据,结合模拟分析结果,针对早晚高峰以及中午等3个典型时段道路交通状况,与传统定时控制方法进行比较,比较结果表明,该方法能够有效地利用车道,增强交通通行能力,较传统的定时控制方式更具有适用性。     

城市区域交通信号迭代学习控制策略

城市交通流具有复杂的非线性动态特性, 在交通控制中难以对其进行精确的数学建模; 同时, 以天为周期, 宏观交通流又呈现出明显的周期性特征. 鉴于此, 提出一种基于迭代学习的城市区域交通信号控制策略, 通过对交通信号的迭代控制, 使路段的平均占有率收敛于期望占有率, 从而使绿灯时间得到充分利用并防止交通拥堵的发生, 保证了交通流在路网中的高效平稳运行. 严格的理论推导证明了该方法的收敛性, 仿真结果验证了该方法的有效性.