Li-rich layered oxides:Structure,capacity and voltage fading mechanisms and solving strategies

Lithium rich layered oxides (LLOs) are attractive cathode materials for Li-ion batteries owing to their high capacity (＞250 mA h g-1) and suitable voltage (～3.6...     

基于MPC8270的处理器板卡设计

随着海洋地震勘探发展,为了实现海洋地震勘探采集数据的实时传输和处理,设计了一种基于MPC8270的地震数据采集处理板卡;根据海洋地震数据采集处理的实时性和大数据量要求以及MPC8270处理器的特性,设计了基于MPC8270和FPGA的CPCI总线通信结构,能够实现地震数据的高速实时传输;详细介绍了MPC8270的关键外围电路、FPGA及CPCI总线电路的硬件设计及实现方法,并在实际应用中给出了板卡嵌入式操作系统VxWorks配置的实现方式;板卡以MPC8270作为核心处理器,以FPGA为控制核心电路,以VxWorks为实时操作系统,实现地震数据的高速处理和CPCI总线实时传输功能;经过多次实验室内部测试及海上实际生产应用,结果表明地震数据采集处理板卡能够实现地震数据的高速处理和实时传输,并且板卡性能稳定可靠;板卡的设计简单,结构通用,对数据处理、总线控制和信息交换等领域相关系统的开发具有一定的参考价值。     

SiH3与NO2反应机理的理论研究

The reaction between silyl radicals and nitric oxide was studied by using the B3LYP/6 311G and the high-level electron-correlation CCSD(T)/6-311G methods. The geometries for reactants, the transition states and the products were completely optimized. All the transition states are verified by the vibrational analysis and the intrinsic reaction coordinate (IRC) calculations. The results show that the reaction is via multi-channel and multi-step. Five products may be formed via the complex reaction channels, i.e. association, H-shift and dissociation.     

混沌系统的变量变化率反馈控制方法研究

设计了一种控制连续非线性系统中混沌的新方法--变量变化率脉冲反馈(VRPF)方法.介绍了VRPF方法的控制原理以及反馈系数和脉冲间隔的选择技巧.将此方法应用到BZ反应3D模型系统混沌的控制中,计算机仿真模拟显示,通过恰当地选择反馈系数和脉冲间隔,可以将系统稳定在1p、2p、3p、4p、…、2n×3mp (n、m为整数)这样不同的周期轨道,从而使系统的功率谱也由混沌态时的连续谱转变为具有分立单峰的分立谱.此外,仿真模拟还发现VRPF方法具有极宽的控制域.     

硅烯及取代硅烯与饱和键插入反应的量子化学研究

用量子化学的密度泛函理论(DFT)在6-311G水平上对硅烯及其取代物与甲烷的C-H键进行插入反应的势能面进行了系统地研究。用IRC方法对过渡态进行了验证。并用组态混合模型讨论了反应势垒(△E^≠)和反应热(△H)与SiXY的单-三态激发能△Est的关系。我们发现,硅烯SiXY的△Est是控制反应的主要因素,取代基的电负性越大,取代基越多,π电子给予越强,SiXY的△Est就越大,插入反应的活化能就越大,放热就越小。     

卤代甲烷的赝势从头算研究I. CH~3X(X=F,Cl, Br,I)的化学键 和电离势

我们使用相对论赝势从头计算方法系统地研究了CH~3X(X=F,Cl,Br,I)系列分子的电子结构及其变化规律,并根据Koopmans定理指定了光电子能谱。     

Limiting distributions of likelihood ratio test for independence of components for high-dimensional normal vectors

Annals of the Institute of Statistical Mathematics - Consider a p-variate normal random vector. We are interested in the limiting distributions of likelihood ratio test (LRT) statistics for testing...     

Limiting Spectral Radii of Circular Unitary Matrices Under Light Truncation

Journal of Theoretical Probability - Consider a truncated circular unitary matrix which is a $$p_n$$ by $$p_n$$ submatrix of an n by n circular unitary matrix after deleting the last $$n-p_n$$...     

A new xanthone derivative from the co-culture broth of two marine fungi (strain No. E33 and K38)

A new xanthone derivative, 8-hydroxy-3-methyl-9-oxo-9H-xanthene-1-carboxylic acid methyl ether (1), was isolated from the co-culture broth of two mangrove fungi (strain No. K38 and E33) isolated from the South China Sea coast. The structure of 1 was determined by comprehensive spectroscopic methods, especially 2D NMR techniques. Primary bioassays showed that compound 1 has inhibitory activity against five microorganisms, including Gloeasporium musae and Peronophthora cichoralearum etc.