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Lecture on the anomalous diffusion in Condensed Matter Physics 关于凝聚态物理中的反常扩散的讲座
Pub Date : 2018-08-27 DOI: 10.23647/ca.md20180730
M. Benhamou
Diffusion is a natural or artificial process that governs many phenomena in nature. The most known diffusion is the Brownian or normal motion, where the mean-square-displacement of the tracer (diffusive particle among others) increases as the square-root of time. It is not the case, however, for complex systems, where the diffusion is rather slow, because at small-scales, these media present an heterogenous structure. This kind of slow motion is called subdiffusion, where the associated mean-square-displacement increases in time, with a non trivial exponent, alpha, whose value is between 0 and 1. In this review paper, we report on new trends dealing with the study of the anomalous diffusion in Condensed Matter Physics. The study is achieved using a theoretical approach that is based on a Generalized Langevin Equation. As particular crowded systems, we choose the so-called Pickering emulsions (oil-in-water), and we are interested in how the dispersed droplets (protected by small solid charged nanoparticles) can diffuse in the continuous phase (water). Dynamic study is accomplished through the mean-square-displacement and the velocity-autocorrelation-function. Finally, a comparison with Molecular Dynamics data is made.
扩散是一种自然或人为的过程,它支配着自然界中的许多现象。最著名的扩散是布朗运动或正常运动,其中示踪剂(扩散粒子等)的均方位移随着时间的平方根而增加。然而,对于扩散相当缓慢的复杂系统,情况并非如此,因为在小尺度下,这些介质呈现异质结构。这种慢动作称为次扩散,其中相关的均方位移随时间增加,具有非平凡指数alpha,其值在0到1之间。本文综述了凝聚态物理中异常扩散研究的最新进展。该研究是利用基于广义朗之万方程的理论方法来实现的。作为特殊的拥挤系统,我们选择了所谓的皮克林乳液(水包油),我们对分散的液滴(由带电的小固体纳米粒子保护)如何在连续相(水)中扩散感兴趣。通过均方位移和速度自相关函数来完成动态研究。最后与分子动力学数据进行了比较。
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引用次数: 1
Investigation of DNA denaturation from generalized Morse potential 广义莫尔斯势对DNA变性的研究
Pub Date : 2018-07-11 DOI: 10.23647/ca.md20180207
R. El Kinani, H. Kaidi, M. Benhamou
In this paper, we present a non-linear model for the study of DNA denaturation transition. To this end, we assume that the double-strands DNA interact via a realistic generalized Morse potential that reproduces well the features of the real interaction. Using the Transfer Matrix Method, based on the resolution of a Schrödinger equation, we first determine exactly their solution, which are found to be bound states. Second, from an exact expression of the ground state, we compute the denaturation temperature and the free energy density, in terms of the parameters of the potential.Then, we calculate the contact probability, which is the probability to find the double-strands at a (finite) distance apart, from which we determine the behaviour of the mean-distance between DNA-strands.The main conclusion is that, the present analytical study reveals that the generalized Morse potential is a good candidate for the study of DNA denaturation
在本文中,我们提出了一个非线性模型的DNA变性转变的研究。为此,我们假设双链DNA通过现实的广义莫尔斯势相互作用,很好地再现了真实相互作用的特征。利用传递矩阵法,在求解Schrödinger方程的基础上,我们首先准确地确定了它们的解,发现它们是束缚态。其次,根据基态的精确表达式,根据势的参数,计算出变性温度和自由能密度。然后,我们计算接触概率,即在(有限)距离处找到双链的概率,由此我们确定dna链之间平均距离的行为。本文的主要结论是,本文的分析研究揭示了广义莫尔斯势是DNA变性研究的一个很好的候选者
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引用次数: 0
Carbon nanotubes functionalized with copper hexacyanoferrate nanoparticles for a selective extraction of cesium from liquid waste 六氰高铁酸铜功能化碳纳米管对废液中铯的选择性萃取
Pub Date : 2018-07-02 DOI: 10.23647/CA.MD20180407
H. Draouil, L. Alvarez, J. Causse, V. Flaud, M. Zaibi, J. Bantignies, M. Oueslati, J. Cambedouzou
Single-walled carbon nanotubes are functionalized with copper hexacyanoferrate nanoparticles for the liquid-solid extraction of cesium from liquid waste and contaminated water. The functionalization process is followed mainly by x-ray photoemission spectroscopy. Indeed, determining the chemical environment around carbon or nitrogen atoms allows to evidence the formation of covalent bounding. In addition, the signatures of iron and copper ions give information on the effective growth of hexacyanoferrate nanoparticles. Furthermore, the cesium sorption mechanism is investigated by comparing the peak intensities associated to the response of potassium and cesium ions. Finally, based on the liquid chromatography analyzes, the sorption of cesium with the functionalized carbon supports is studied. The main results of this work are the demonstration of both a good selectivity of cesium trapping and a high sorption capacity by hybrid single-walled carbon nanotubes.
采用六氰高铁酸铜纳米粒子对单壁碳纳米管进行了功能化处理,用于液固萃取废液和污水中的铯。功能化过程主要通过x射线光发射光谱进行。事实上,确定碳或氮原子周围的化学环境可以证明共价键的形成。此外,铁离子和铜离子的特征为六氰高铁酸盐纳米颗粒的有效生长提供了信息。此外,通过比较钾离子和铯离子响应的峰值强度,研究了铯的吸附机理。最后,在液相色谱分析的基础上,研究了功能化碳载体对铯的吸附。本工作的主要结果是证明了杂化单壁碳纳米管具有良好的铯捕获选择性和较高的吸附能力。
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引用次数: 0
Extensive study of cage effect and subdiffusion in Pickering emulsions using molecular dynamics simulations 利用分子动力学模拟广泛研究皮克林乳剂中的笼形效应和亚扩散
Pub Date : 2018-05-04 DOI: 10.23647/ca.md20182404
S. El-moudny, M. Benhamou
In this work, we aim at an extensive study of the diffusion phenomenon of oil-droplets dispersed in water onto which are strongly adsorbed charged point-like particles (Pickering emulsions). This diffusion that originates from multiple collisions with the molecules of water, is anomalous, due to the presence of relatively strong correlations between the moving oil-droplets. Using Molecular Dynamic simulation, with a pair-potential of Sogami-Ise type, we first observe that the random walkers execute a normal diffusion, at intermediate time, followed by a slow diffusion (subdiffusion) we attribute to the presence of cages, formed by the nearest neighbors (traps). In the cage-regime, we find that the mean-square-displacement increases according to a time-power law, with an anomalous diffusion exponent between 0 and 1. The existence of a cage effect is shown also by computing the velocity auto-correlation function of the random walker. It is found that, in a cage, this function is governed by an underdamped (oscillatory) behavior, for strong densities and surface charges, and low-salt concentration. In the inverse situation, however, we observe that this correlation-function is rather overdamped (non-oscillatory). In the two cases, at large-time, this function fails according to a time-power law.
在这项工作中,我们旨在广泛研究油滴分散在水中的扩散现象,这些扩散现象被强吸附的带电点状颗粒(皮克林乳液)所吸附。由于移动的油滴之间存在相对强的相关性,这种起源于与水分子多次碰撞的扩散是反常的。利用Sogami-Ise型对势的分子动力学模拟,我们首先观察到随机步行者执行正常扩散,在中间时间,随后是缓慢扩散(亚扩散),我们将其归因于由最近邻居(陷阱)形成的笼子的存在。在笼区,我们发现均方位移按时间-幂律增加,扩散指数在0和1之间呈反常。通过计算随机步行者的速度自相关函数,证明了笼效应的存在性。我们发现,在笼中,对于高密度和表面电荷以及低盐浓度,该函数受欠阻尼(振荡)行为的支配。然而,在相反的情况下,我们观察到这个相关函数相当过阻尼(非振荡)。在这两种情况下,在大时间内,这个函数根据时间-幂律失效。
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引用次数: 0
ZnTe/CdSe type-II core/shell spherical quantum dot under an external electric field 外加电场作用下的ZnTe/CdSe型核/壳球形量子点
Pub Date : 2018-04-07 DOI: 10.23647/ca.md20180504
A. Chafai
We have investigated in the framework of the envelope function approximation and taking into account the dependence of the electron effective mass on radius the energy of an electron inside a ZnTe/CdSecore/shell spherical quantum dot. In order to make the problem more realistic, we describe the conduction band-edge alignment between core and shell materials by a finite height barrier. By applying the Ritz variational principle the effect of the electric field on the electronic states was also examined. Our numerical results show the opportunity to control the energy states position of the charge carriers inside our core/shell nanostructures by controlling the size (core radius, shell thickness) of the nanostructure and the strength of the external electric field. #CORE/SHELL MATERIALS #NANOSTRUCTURES #QUANTUM DOTS #ELECTRIC FIELD
我们研究了包络函数近似的框架,并考虑了电子有效质量对ZnTe/CdSecore/壳球形量子点内电子能量半径的依赖。为了使问题更加现实,我们用有限高度的障壁来描述芯壳材料之间的导带边缘对准。应用里兹变分原理,考察了电场对电子态的影响。我们的数值结果表明,通过控制纳米结构的尺寸(核半径、壳层厚度)和外电场的强度,可以控制我们的核/壳纳米结构中载流子的能态位置。#核/壳材料#纳米结构#量子点#电场
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引用次数: 2
Vortex phase transition and superconducting properties in quasi-two-dimensional k-(BEDT-TTF)2Cu[N(CN)2]Br organic superconductor 准二维k-(BEDT-TTF)2Cu[N(CN)2]Br有机超导体的涡旋相变和超导性能
Pub Date : 2018-03-21 DOI: 10.23647/ca.md20181603
H. Ouaddi, A. Tirbiyine, A. Taoufik, Y. A. Ahmed, Fatiha Chiban, H. Chaib, A. Nafidi, S. Senoussi
We report investigations of the low temperature dc susceptibility and the magnetization on the layered organic superconductor k-(BEDT-TTF)2Cu[N(CN)2]Br near 80 K and the effect of disorder on the superconducting transition temperature Tc. The shielding effect (S) and the critical current density Jc were studied (with H parallel to the c axis of the crystal). Jc can be estimated by analysis of magnetic hysteresis measurement using the Bean model. For each temperature value, we observed two regimes in the critical current density Jc(H). Our results show that the magnetic properties of these compounds depend strongly on the cooling rate. The structural transformation which occurs at the vicinity of 80 K very strongly influences the physics of vortex lattice and the associated magnetic behavior. #organic_superconductor #critical_current #shielding_effect #magnetic_susceptibility #vortex_pinning
本文报道了层状有机超导体k-(BEDT-TTF)2Cu[N(CN)2]Br在80k附近的低温直流磁化率和磁化率,以及无序对超导转变温度Tc的影响。研究了屏蔽效应(S)和临界电流密度(H平行于晶体c轴)。利用Bean模型对磁滞测量结果进行分析,可以估计出Jc。对于每个温度值,我们观察到临界电流密度Jc(H)的两种变化。我们的结果表明,这些化合物的磁性能在很大程度上取决于冷却速度。在80k附近发生的结构转变对涡旋晶格的物理性质和相关的磁性行为影响很大。#organic_superconductor #critical_current #shielding_effect # magnetic_磁化率#vortex_pin
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引用次数: 0
Raman active modes in defective peapods 缺陷豆荚的拉曼活性模式
Pub Date : 2018-03-09 DOI: 10.23647/ca.md20180803
F. Fergani, S.M. Ait Abdelkader, H. Chadli, A. Rahmani, A. Rahmani
The vibrational properties of defective single-walled carbon nanotube filled with C60 fullerene is the subject of the current study. For this aim we use the spectral moments method in the framework of the bond-polarization theory to calculate the non-resonant Raman spectra of hexa-vacancy defective C60 peapods. Essentially, the vibrational properties are closely coupled with the atomic structure of the system. The evolution of the Raman spectrum as a function of the spatial arrangement of defects in carbon nanotubes is discussed. This work provides benchmark theoretical results to understand the experimental data of defective C60 peapods. #single_wall_carbon_nanotube #C60_peapods #hexa-vacancy_defect #Raman_spectroscopy #pectral_moment_method
C60富勒烯填充缺陷单壁碳纳米管的振动特性是当前研究的主题。为此,我们采用键极化理论框架下的谱矩法计算了六空位缺陷C60豆荚的非共振拉曼光谱。从本质上讲,振动特性与系统的原子结构密切相关。讨论了碳纳米管中拉曼光谱随缺陷空间排列的变化规律。本工作为理解C60缺陷豆荚的实验数据提供了基准理论结果。#Raman_spectroscopy #pectral_moment_method
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引用次数: 0
Identification of mono-and few-layer graphene: Raman study 单层和多层石墨烯的鉴定:拉曼研究
Pub Date : 2018-03-06 DOI: 10.23647/ca.md20180503
M. Boutahir, A. Rahmani, H. Chadli, A. Rahmani
In this theoretical work, the Raman spectra were analyzed by considering the origin of the G peak, its shape, position and relative intensity as a function of the number of graphene layers. By using the spectral moment’s method, the Raman spectra of mono, bi and few-layers of graphene are calculated and a good agreement was found with group theory concerning the number of the Raman-active modes and the Raman measurements. Our results provide a Raman analysis to evaluate the number of layers in multilayer graphene. #Raman_spectroscopy #graphene #graphite
在这项理论工作中,通过考虑G峰的起源,其形状,位置和相对强度作为石墨烯层数的函数来分析拉曼光谱。利用谱矩法计算了单层、双层和多层石墨烯的拉曼光谱,得到了与群论一致的拉曼活性模数和拉曼测量值。我们的研究结果提供了拉曼分析来评估多层石墨烯的层数。#拉曼光谱#石墨烯#石墨
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引用次数: 0
2nd International Symposium on Physics of Data Storage; Conference Volume 第二届数据存储物理国际研讨会;会议数量
Pub Date : 2018-02-10 DOI: 10.23647/ca.md20172012
Abdelhai Rahmani
The symposium ISPDS2 has taken place in Meknes (Morocco) in October, 2017. It has gathered specialists of various fields who presented their work in connection with the problematics of data storage. This conference volume contains 75 abstracts of communications presented at the meeting as invited conferences, talks, or posters. Various topics are covered, as carbon nanotubes, SWCN, Domain walls, piezoelectrics, anomalous diffusion, electron microscopy, spectral moments, SiGe, nanocrystals, magneto-caloric, electro-caloric, ferrite, spinels, perovskites, graphene, solar cells, colossal magnetoresistance (CMR)
ISPDS2研讨会于2017年10月在摩洛哥梅克内斯举行。它聚集了各个领域的专家,他们介绍了他们在数据存储问题方面的工作。本会议卷包含75个在会议上作为邀请会议、会谈或海报提出的通讯摘要。涵盖了各种主题,如碳纳米管,SWCN,畴壁,压电,异常扩散,电子显微镜,光谱矩,SiGe,纳米晶体,磁热,电热,铁氧体,尖晶石,钙钛矿,石墨烯,太阳能电池,巨磁阻(CMR)。
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引用次数: 1
Transpyrenean Encounter on Advanced Materials 先进材料上的透光邂逅
Pub Date : 2017-08-29 DOI: 10.23647/ca.md20170407
P. Saint-Grégoire
TEAM1 has taken place in Sete (France) on 4, 5, 6 july 2017. It has gathered a little less than 40 participants who presented communications on various fields of advanced materials, and on experimental facilities or experimental methods, that are briefly summarized in the present volume. Presented abstracts deal with fullerenes, graphene, thin films, oxides, ferroelectrics, pyroelectrics, piezoelectrics, superconductors, nanomaterials, photovoltaics, X-ray diffraction, electron diffraction, electron microscopy, electron holography, carbon nanotubes, nanorods, ZnO.
TEAM1已于2017年7月4、5、6日在塞特(法国)举行。它聚集了不到40名与会者,他们就先进材料的各个领域以及实验设施或实验方法发表了交流意见,本卷将对此进行简要总结。所提供的摘要涉及富勒烯、石墨烯、薄膜、氧化物、铁电体、热释电体、压电体、超导体、纳米材料、光伏、x射线衍射、电子衍射、电子显微镜、电子全息、碳纳米管、纳米棒、ZnO。
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引用次数: 1
期刊
OAJ Materials and Devices
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