Effect of temperature on the interactions between cellulose and lignin via molecular dynamics simulations

Cellulose - Heating is essential in various biomass pre-treatments and thermal conversion processes. It is of practical significance to study the characteristics of cellulose-lignin and...     

Visible light-driven acridone catalysis for atom transfer radical polymerization

Acridone as a new kind of visible light photocatalyst has been developed to catalyze metal free atom transfer radical polymerization (ATRP). The photocatalyst possess low excited state potential as can undergo an oxidative quenching pathway to initiate ATRP of vinyl monomers. Kinetic study and light on/off reaction demonstrate the “living”/controlled nature of the polymerization by light. Block copolymers can be achieved by using PMMA as macroinitiator to reinitiate polymerization of other vinyl monomers, which shows highly preserved Br chain-end functionality in the synthesized polymers. Moreover, the polymerization can be conducted under air atmosphere as most photocatalysts need anaerobic condition, which may give inspiration of further application of this kind of photocatalyst.     

Dynamic mechanism of epileptic seizures generation and propagation after ischemic stroke

Nonlinear Dynamics - Epilepsy is the second largest neurological disease which seriously threatens human life and health. The one important reason of inducing epileptic seizures is ischemic stroke...     

大学生童年受忽视经历对自尊的影响:应对方式的中介作用

为研究大学生在童年时受到忽视与自尊水平、应对方式之间的关系,采用方便抽样法,向430名学生发放童年受忽视量表、简易应对方式量表和自尊量表,使用统计软件SPSS17.0进行数据整理与分析,结果表明,大学生在童年时受到的忽视与自尊、处理应对的积极方式是负相关关系(r=-0.164,r=-0.246,P<0.01),忽视与消极应对方式呈正相关关系(r=0.152,P<0.01);自尊与大学生采用积极的应对方式呈正相关关系(r=0.398,P<0.01),与采用消极的应对方式呈负相关关系(r=-0.217,P<0.01);不同的应对方式在面临忽视与自尊之间起着协调作用,积极应对方式的协调效果有29.4%,而消极应对方式的协调效果则只有12.6%,差距十分明显。因此,大学生在童年时受到忽视与自尊、不同的应对方式会收到完全不同的协调效果。     

A New Approach to Develop a Standardized Method for Simultaneous Analysis of Astragaloside IV and Formononetin in Radix Astragali by High-Performance Thin-Layer Chromatography

JPC – Journal of Planar Chromatography – Modern TLC - A new high-performance thin-layer chromatographic (HPTLC) method has been developed for the simultaneous estimation of...     

高职院校图书馆新生入馆教育工作创新研究

对几种新生入馆教育方式的优缺点进行了比较分析,以山东商务职业学院图书馆为例,详细介绍了宣传片拍摄要领及技巧,提出了一种综合性的新生入馆教育新模式.     

工程实践中的体系与系统

 介绍了国际上通行的体系概念，通过实例阐述了常见的体系类型，从多个维度描述了系统与体系的区别，根据实践总结，提出体系与系统的核心界定准则，并结合工程实践进行了详细描述。     

Pentapnictogen heterocyclic monoanions: Structure,stability, and aromaticity

Inorganic planar ring-shape molecules with 4n + 2 π electrons are always the focus of experimental synthesis and theoretical research due to their potential aromaticity and stability. In this work, the whole series of five-membered heterocycle monoanions X _nY_5-n⁻ (X, Y = group 15 elements; n = 1-4) were thoroughly investigated by means of density functional theory calculations. They all have large formation energies and HOMO-LUMO gap energies, suggesting the potential thermodynamic and kinetic stability. Their aromaticities are comparable to that of typical aromatic hydrocarbons. Their thermal stabilities were firmly established by the ab initio molecular dynamics simulations. As most of them are predicted for the first time, their various spectra were simulated for experimental characterization. Furthermore, we demonstrate that these five-membered cyclic anions can be employed as η⁵-ligand to construct novel all-inorganic metallocenes, which may serve as the building blocks of low-dimensional nanomaterials.