基于视觉辐条图案识别方法的蓝宝石引晶机制研究

工业生产蓝宝石晶体过程中,引晶步骤有着至关重要的地位。引晶必须在温度梯度较小,温度分布趋于稳定的条件下进行。目前,工业生产蓝宝石主要依靠人工经验操控籽晶杆实现引晶操作,但是人工引晶操作的准确性不高会导致成品品质不佳、资源浪费。为此,本文提出一种基于蓝宝石视觉辐条图案识别方法来检测蓝宝石熔体状态自由液面状态,从而实现一种高效率引晶的机制。此方法利用经典骨架化算法细化辐条图案,Harris算子实现特征信息的提取,提取的特征信息放入运动轨迹模型中判断熔体稳定性,分析液面温度分布稳定性从而实现引晶。结果表明,此算法具有有效性,蓝宝石晶体引晶效率大大提高,生产出的成品良率也有提升,可有效指导蓝宝石的工业生产。     

Moderate Deviation for the Rightmost Position in a Branching Brownian Motion

We study the moderate deviation probability of the position of the rightmost particle in a branching Brownian motion and obtain its moderate deviation function. Firstly, Chauvin and Rouault studied the large deviation probability for the rightmost position in a branching Brownian motion. Recently, Derrida and Shiconsidered lower deviation for the same model. By contrast, Our main result is more extensive.     

An approach to characterization of the agricultural self-propelled machines stability

This paper presents an analytical algorithm with appropriate software specified for the approximation of the allowed critical slope of the solid flat terrain that guarantees static and/or dynamic stability of the specified self-propelled agricultural machines and their aggregates. This algorithm assumes machine as a rigid body, having 3 or 4 contact points (defined by wheels or crawlers), under uniform motion at different constant velocities and radii of curvature trajectories. Using this algorithm, based on the principles of theoretical mechanics combined with 3D analytical geometry, the computer program SSPM (stability of the self-propelled agricultural machines) has been coded. This software is intended to facilitate the analysis, comparison and optimization of different configurations of self-propelled agricultural machines in operation on horizontal and sloped flat terrains at constant velocities and radii of trajectory with respect to their static and dynamic stability. It calculates critical pitch and roll angles of the self-propelled machine and the maximum allowed slope of the flat terrain under the given conditions. The algorithm and the appropriate SSPM software were experimentally verified using the platform and low-scale tractor model. Average difference between calculated and experimental critical values of roll and pitch angles were about 4°     

“Through-Space” Relativistic Effects on NMR Chemical Shifts of Pyridinium Halide Ionic Liquids

We have investigated, using two-component relativistic density functional theory (DFT) at ZORA-SO-BP86 and ZORA-SO-PBE0 level, the occurrence of relativistic effects on the ¹H, ¹³C, and ¹⁵N NMR chemical shifts of 1-methylpyridinium halides [MP][X] and 1-butyl-3-methylpyridinium trihalides [BMP][X₃] ionic liquids (ILs) (X=Cl, Br, I) as a result of a non-covalent interaction with the heavy anions. Our results indicate a sizeable deshielding effect in ion pairs when the anion is I⁻ and I₃⁻. A smaller, though nonzero, effect is observed also with bromine while chlorine based anions do not produce an appreciable relativistic shift. The chemical shift of the carbon atoms of the aromatic ring shows an inverse halogen dependence that has been rationalized based on the little C-2s orbital contribution to the σ-type interaction between the cation and anion. This is the first detailed account and systematic theoretical investigation of a relativistic heavy atom effect on the NMR chemical shifts of light atoms in the absence of covalent bonds. Our work paves the way and suggests the direction for an experimental investigation of such elusive signatures of ion pairing in ILs.     

Reverse Thinking of the Aggregation-Induced Emission Principle: Amplifying Molecular Motions to Boost Photothermal Efficiency of Nanofibers**

Using reverse thinking of the aggregation-induced emission (AIE) principle, we demonstrate an ingenious and universal protocol for amplifying molecular motions to boost photothermal efficiency of fibers. Core–shell nanofibers having the olive oil solution of AIE-active molecules as the core surrounded by PVDF-HFP shell were constructed by coaxial electrospinning. The molecularly dissolved state of AIE-active molecules allows them to freely rotate and/or vibrate in nanofibers upon photoexcitation and thus significantly elevates the proportion of non-radiative energy dissipation, affording impressive heat-generating efficiency. Photothermal evaluation shows that the core–shell nanofibers with excellent durability can reach up to 22.36 % of photothermal conversion efficiency, which is 26-fold as the non-core–shell counterpart. Such a core–shell fiber can be used for photothermal textiles and solar steam generation induced by natural sunlight with green and carbon-zero emission.     

基于六面体网格的向量式有限元分析及应用

基于向量式有限元基本原理，给出了八节点六面体等参实体单元的基本公式，通过投影方式将空间曲面六面体转换为投影六面体，采用参考面的逆向运动求解节点纯变形，通过单元形函的虚功方程计算节点内力；针对坐标模式和内力积分模式等关键问题提出了有效的处理方案。编制了六面体实体单元的数值计算程序，并进行工程结构算例分析。结果表明，所编制程序可有效模拟实体结构的静力、动力及大变形大位移行为分析，验证了本文理论和程序的正确性和实用性。     

Quantum effects on the stability of the He5I2 van der Waals conformers

We present 15-dimensional quantum multiconfiguration time-dependent Hartree calculations of the vibrational levels of the He₅I₂ van der Waals (vdW) complex employing an ab initio-based potential energy surface (PES). The energies and spatial features of such bound structures are analyzed, providing predictions on the structures and relative stabilities of its three lowest isomers. We found that the most stable isomer corresponds to all five He atoms encircling the I₂ molecule, indicating that in this case the anharmonic quantum effects do not stabilize the isomers involving a He atom in a linear configuration as reported previously for the smaller He_NI₂ systems. Such finding provides information on the overall structuring of the finite-size-solvent systems, highlighting the intriguing interplay between weak intermolecular interactions and quantum effects. © 2019 Wiley Periodicals, Inc.