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国家自然科学基金(10972217)

作品数:7 被引量:10H指数:2
相关作者:孙祉伟徐升华顾凌云阿燕杜嬛更多>>
相关机构:中国科学院力学研究所山东师范大学更多>>
发文基金:国家自然科学基金中国科学院知识创新工程重要方向项目中国科学院知识创新工程更多>>
相关领域:理学化学工程建筑科学机械工程更多>>

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Two examples of using physical mechanics approach to evaluate colloidal stability被引量:2
2012年
Since Mr.Tsien brought up his idea of physical mechanics,as a new field in engineering science,to public attention in the early 50's of the 20th century,innumerable application examples of physical mechanics approach in diverse fields have manifested its strong vitality increasingly.One of important aspects in applications of physical mechanics is to appropriately choose the microscopic quantity for the system in consideration and build a bridge to connect its relevant microscopic information to its desired macroscopic properties.We present two unique cases of using the physical mechanics approach to study colloidal stability.In the first case we measured the outcomes from artificially induced collisions at individual particle levels,by means of directly observing artificially induced collisions with the aid of optical tweezers.In the second case,by using T-matrix method,the microscopic quantity extinction cross section of the doublet can be accurately evaluated and therefore the measurement range and accuracy of the turbidity methodology for determining the CRC are greatly improved.
SUN ZhiWeiXU ShengHua
带电粒子形成胶体晶体的有效硬球模型判据的计算机模拟验证被引量:3
2011年
在对胶体晶体的研究中,带电粒子胶体晶体的形成机理比硬球胶体晶体更加复杂,对其形成条件目前还缺少有效的判断依据.有效硬球模型判据提出以有效直径作为判断参数.为了验证该判据的有效性,利用布朗动力学模拟研究了不同有效直径下带电粒子胶体晶体的特性.为了更加定量地研究单因素对带电胶体晶体形成的影响,取有效直径为2.8至0.8,并对一定的有效直径,研究了粒子几何直径和排斥力不同情况下的结晶行为.在布朗动力学模拟过程中,采用径向分布函数和键序参数方法检测体系的结构变化,并分析所形成的晶体结构.结果表明,在判断带电粒子胶体体系能否形成有序结构方面,有效硬球模型判据有一定的合理性.但是,并不能将有效直径作为唯一的判别参数,而是需要综合其他参数的影响,这显示出该判据的片面性.
顾凌云徐升华孙祉伟
Coupling effect of Brownian motion and laminar shear flow on colloid coagulation:a Brownian dynamics simulation study
2012年
Simultaneous orthokinetic and perikinetic coagulations(SOPCs) are studied for small and large Peclet numbers(P e) using Brownian dynamics simulation.The results demonstrate that the contributions of the Brownian motion and the shear flow to the overall coagulation rate are basically not additive.At the early stages of coagulation with small Peclet numbers,the ratio of overall coagulation rate to the rate of pure perikinetic coagulation is proportional to P 1/2 e,while with high Peclet numbers,the ratio of overall coagulation rate to the rate of pure orthokinetic coagulation is proportional to P 1/2 e.Moreover,our results show that the aggregation rate generally changes with time for the SOPC,which is different from that for pure perikinetic and pure orthokinetic coagulations.By comparing the SOPC with pure perikinetic and pure orthokinetic coagulations,we show that the redistribution of particles due to Brownian motion can play a very important role in the SOPC.In addition,the effects of redistribution in the directions perpendicular and parallel to the shear flow direction are different.This perspective explains the behavior of coagulation due to the joint effects of the Brownian motion(perikinetic) and the fluid motion(orthokinetic).
徐升华孙祉伟李旭Jin Tong Wang
流体力学半径对估算胶体微球聚集速率常数的影响被引量:2
2010年
胶体粒子聚集速率常数实验值远低于理论值一直是被普遍关注的问题.聚集速率常数的理论推导是基于粒子的几何半径来考虑的,但决定粒子扩散速率及聚集速率的应该是粒子的流体力学半径(大于几何半径),因而它是使聚集速率常数实验值低于理论值的因素之一.影响流体力学半径的因素很多,其中,带电粒子在溶液中因表面存在双电层,会明显增大流体力学半径,造成聚集速率减慢.而双电层的厚度又随溶液中离子强度的不同而改变.本工作在聚集速率的公式中引入了修正因子,即几何半径与其流体力学半径之比,以修正由于用几何半径代替流体力学半径带来的误差.其中几何半径和流体力学半径可以分别用扫描电镜(SEM)和动态光散射(DLS)来测定.以两种粒径的聚苯乙烯带电微球为例,考察了在不同离子强度下,该误差的大小.结果发现,对于半径为30 nm的微球,用流体力学半径计算的慢聚集速率常数比理论值偏低约8%.该误差随离子强度增加而减少.对于快聚集情况,流体力学半径对聚集速率基本没有影响.
杜嬛徐升华孙祉伟阿燕
关键词:聚苯乙烯微球离子强度
Gas-liquid phase coexistence and finite-size effects in a two-dimensional Lennard-Jones system被引量:1
2011年
The gas-liquid phase coexistence in a two-dimensional Lennard-Jones system is investigated using Maxwell construction method together with molecular dynamics simulations.The results of phase coexistence in different truncations of the potential are compared with data obtained from the literature,and the corresponding critical properties calculated.The crossover from Ising-like to mean field behavior is observed and confirmed as the temperature approaches the critical point from below.Performing simulations on systems with different sizes,we find that a finite size effect is more significant than those shown in most of the previous results,and a lower critical temperature is obtained when the full extent of this finite size effect is considered.
OUYANG WenZe XU ShengHua SUN ZhiWei
关键词:有限尺寸效应气液相分子动力学模拟临界温度
光散射聚集速率测定中T矩阵方法的应用被引量:2
2013年
聚集速率是评估胶体体系特性及稳定性的关键参数,静态光散射和动态光散射则是测量聚集速率的两个重要方法.然而,用静态光散射和动态光散射测量聚集速率时,需要知道有关单粒子和双粒子聚集体光散射特性的数据.为此,通常需要把动、静两种方法结合,才能消去这个数据.以前各种近似理论曾用来解决这个问题,但因粒子尺寸和形状的限制,结果并不理想.而T矩阵方法可以不受粒子大小和形状的限制计算其光散射特性.本工作用T矩阵方法直接计算静态光散射和动态光散射所必须的粒子散射特性,并将该法得到的聚集速率与动静态光散射结合法得到的聚集速率进行了比较,两者结果很接近.本工作为简化静态光散射和动态光散射测量聚集速率,扩展其应用范围开辟了新途径.
米利周宏伟孙祉伟刘丽霞徐升华
关键词:T矩阵光散射法
Polymorph selection in the crystallization of hard-core Yukawa system
2016年
Colloid-colloid interactions in charge-stabilized dispersions can to The crystallization process and polymorph selection of hard-core some extent be represented by the hard-core Yukawa model. Yukawa model are studied by means of smart Monte Carlo simulations in the region of face-centered-cubic (fcc) phase. The contact value of bard-core Yukawa potential and the volume fraction of the colloids are fixed, while the Debye screening length can be varied. In the early stage of the crystallization, the precursors with relatively ordered liquid structure have been observed. Although the crystal structure of thermodynamically stable phase is fcc, the system crystallizes into a mixture of fcc and hexagonal close-packed (hcp) structures under small Debye screening length since the colloidal particles act as effective hard spheres. In the intermediate range of Debye screening length, the system crystallizes into a mixture of fcc, hcp, and body-centered-cubic (bcc). The existence of metastable hcp and bcc structures can be interpreted as a manifestation of the Ostwald's step rule. Until the Debye screening length is large enough, the crystal structure obtained is almost a complete fcc suggesting the system eventually reaches to a thermodynamically stable state.
Wenze OuyangZhiwei SunJun ZhongHongwei ZhouShenghua Xu
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