研究了环面上非线性 van der Pol方程的图形建模及可视化计算的问题 .在图形环境下 ,对 van der Pol环面方程从建模、实验到结果分析的全过程进行了可视化建模和计算 ,并建立了一个对系统运动轨迹进行全面自动分析试验的可视化仿真框架 ...研究了环面上非线性 van der Pol方程的图形建模及可视化计算的问题 .在图形环境下 ,对 van der Pol环面方程从建模、实验到结果分析的全过程进行了可视化建模和计算 ,并建立了一个对系统运动轨迹进行全面自动分析试验的可视化仿真框架 .该方法不但可以不用传统程序代码对模型及算法编程 。展开更多
Surface adsorption plays a crucial role in various natural and industrial processes,particularly in the field of energy storage.The adsorption of sodium atoms on 2D layered materials can significantly impact their per...Surface adsorption plays a crucial role in various natural and industrial processes,particularly in the field of energy storage.The adsorption of sodium atoms on 2D layered materials can significantly impact their performance as carriers and electrodes in ion batteries.While it is commonly acknowledged that pristine graphene is not favorable for sodium ion adsorption,the suitability of other 2D materials with similar honeycomb symmetry remains unclear.In this study,we employ systematic first-principles calculations to explore interlayer interactions and electron transfer effects on sodium adsorption on 2D van der Waals(vdW)heterostructures(HTSs)surfaces.Our results demonstrate that sodium adsorption is energetically favorable on these substrates.Moreover,we find that the adsorption strength can be effectively tuned by manipulation of the electron accumulation or depletion of the layer directly interacting with the sodium atom.By stacking these layered materials with different electron abundancy to form vd W HTSs,the charge density of the substrate becomes tunable through interlayer charge transfer.In these vdW HTSs,the adsorption behavior of sodium is primarily controlled by the absorption layer and exhibits a linear correlation with its pz-band center.Additionally,we identify linear correlations between the sodium adsorption energies,the electron loss of the sodium atom,the interlayer charge transfer,and the heights of the adsorbed sodium atom.These discoveries underscore the impact of interlayer electron transfer and interactions on sodium ion adsorption on 2D vd W HTSs and providing new insights into material design for alkali atom adsorption.展开更多
A new 1,3,4 thiadiazole-derivative ligand 2,5-(s-acetic acid) dimercapto-1,3,4 thiadiazole (H2ADTZ) and its one-dimensional manganese polymer Mn(ADTZ)·4H2O had been synthesized and structurally characterized by X...A new 1,3,4 thiadiazole-derivative ligand 2,5-(s-acetic acid) dimercapto-1,3,4 thiadiazole (H2ADTZ) and its one-dimensional manganese polymer Mn(ADTZ)·4H2O had been synthesized and structurally characterized by X-ray single crystal diffraction in this paper. The Mn(Ⅱ) ion is coordinated with a distorted octahedron by two oxygen atoms from neighboring two deprotonated ligands ADTZ2- and other four oxygen atoms from four coordinated water molecules. The structural feature of the title compound is the formation of one-dimensional manganese chains polymer through the bridging of dioxygen O-O units. In the solid state structure of the complex, one-dimensional manganese chains are joined together by the weak intermolecular hydrogen bonds and vander Waals interactions forming a two-dimensional supramolecular compound. Furthermore, the UV spectra and electro-chemical properties of the title compound were also investigated. CCDC: 260532.展开更多
我国经济飞速发展推动民航飞行流量跳跃式增长,对管制系统安全目标水平提出了更高的要求,如何控制管制系统运行风险成为研究重点。针对这一目标,提出了管制系统的风险控制系统概念,引入折叠突变模型,通过分析管制系统风险事故统计数据...我国经济飞速发展推动民航飞行流量跳跃式增长,对管制系统安全目标水平提出了更高的要求,如何控制管制系统运行风险成为研究重点。针对这一目标,提出了管制系统的风险控制系统概念,引入折叠突变模型,通过分析管制系统风险事故统计数据确定系统突变特征及人、机、环、管4种因素耦合风险对系统状态的影响程度;基于Van der PolDuffing方程,应用多尺度法对耦合风险分岔导致折叠突变的影响参数进行研究,设计管制系统内部阻尼调节系数和外部影响因素幅值系数两个风险控制器,确定风险控制要素。结果表明:人为因素耦合风险对管制系统的影响程度最大;设计的风险控制器具有可行性,能够抑制折叠突变发生,保证管制系统处于稳定状态。展开更多
文摘研究了环面上非线性 van der Pol方程的图形建模及可视化计算的问题 .在图形环境下 ,对 van der Pol环面方程从建模、实验到结果分析的全过程进行了可视化建模和计算 ,并建立了一个对系统运动轨迹进行全面自动分析试验的可视化仿真框架 .该方法不但可以不用传统程序代码对模型及算法编程 。
基金the financial support by the National Key Research and Development Program of China(No.2019YFA0708700)the National Natural Science Foundation of China(Nos.62305196,U23B2087 and 62375158)+4 种基金the China Postdoctoral Science Foundation(No.GZC20231498)the Qingdao Postdoctoral Innovation Project(No.QDBSH20240102078)the Postdoctoral Innovation Program of Shandong Province(No.SDCX-ZG-202400318)Science and Technology Research Project of Hubei Provincial Department of Education(No.D20212603)Hubei University of Arts and Science(No.2020kypytd002)。
文摘Surface adsorption plays a crucial role in various natural and industrial processes,particularly in the field of energy storage.The adsorption of sodium atoms on 2D layered materials can significantly impact their performance as carriers and electrodes in ion batteries.While it is commonly acknowledged that pristine graphene is not favorable for sodium ion adsorption,the suitability of other 2D materials with similar honeycomb symmetry remains unclear.In this study,we employ systematic first-principles calculations to explore interlayer interactions and electron transfer effects on sodium adsorption on 2D van der Waals(vdW)heterostructures(HTSs)surfaces.Our results demonstrate that sodium adsorption is energetically favorable on these substrates.Moreover,we find that the adsorption strength can be effectively tuned by manipulation of the electron accumulation or depletion of the layer directly interacting with the sodium atom.By stacking these layered materials with different electron abundancy to form vd W HTSs,the charge density of the substrate becomes tunable through interlayer charge transfer.In these vdW HTSs,the adsorption behavior of sodium is primarily controlled by the absorption layer and exhibits a linear correlation with its pz-band center.Additionally,we identify linear correlations between the sodium adsorption energies,the electron loss of the sodium atom,the interlayer charge transfer,and the heights of the adsorbed sodium atom.These discoveries underscore the impact of interlayer electron transfer and interactions on sodium ion adsorption on 2D vd W HTSs and providing new insights into material design for alkali atom adsorption.
文摘A new 1,3,4 thiadiazole-derivative ligand 2,5-(s-acetic acid) dimercapto-1,3,4 thiadiazole (H2ADTZ) and its one-dimensional manganese polymer Mn(ADTZ)·4H2O had been synthesized and structurally characterized by X-ray single crystal diffraction in this paper. The Mn(Ⅱ) ion is coordinated with a distorted octahedron by two oxygen atoms from neighboring two deprotonated ligands ADTZ2- and other four oxygen atoms from four coordinated water molecules. The structural feature of the title compound is the formation of one-dimensional manganese chains polymer through the bridging of dioxygen O-O units. In the solid state structure of the complex, one-dimensional manganese chains are joined together by the weak intermolecular hydrogen bonds and vander Waals interactions forming a two-dimensional supramolecular compound. Furthermore, the UV spectra and electro-chemical properties of the title compound were also investigated. CCDC: 260532.
文摘我国经济飞速发展推动民航飞行流量跳跃式增长,对管制系统安全目标水平提出了更高的要求,如何控制管制系统运行风险成为研究重点。针对这一目标,提出了管制系统的风险控制系统概念,引入折叠突变模型,通过分析管制系统风险事故统计数据确定系统突变特征及人、机、环、管4种因素耦合风险对系统状态的影响程度;基于Van der PolDuffing方程,应用多尺度法对耦合风险分岔导致折叠突变的影响参数进行研究,设计管制系统内部阻尼调节系数和外部影响因素幅值系数两个风险控制器,确定风险控制要素。结果表明:人为因素耦合风险对管制系统的影响程度最大;设计的风险控制器具有可行性,能够抑制折叠突变发生,保证管制系统处于稳定状态。
