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Using a continuum description, we account for fluctuations in the ionic solvent surrounding a Gaussian, charged chain and derive an effective short-ranged potential between the charges on the chain. This potential is repulsive at short…

软凝聚态物质 · 物理学 2009-11-10 Shirish M. Chitanvis

We present a set of molecular dynamics (MD) simulations of strongly charged, flexible polyelectrolyte chains under poor solvent conditions in a salt free solution. Structural properties of the chains and of the solutions are reported. By…

软凝聚态物质 · 物理学 2007-05-23 Uwe Micka , Christian Holm , Kurt Kremer

By an efficient algorithm we evaluate exactly the disorder-averaged statistics of globally neutral self-avoiding chains with quenched random charge $q_i=\pm 1$ in monomer i and nearest neighbor interactions $\propto q_i q_j$ on square (22…

软凝聚态物质 · 物理学 2009-10-31 P. Monari , A. L. Stella

We present a detailed study of the static and dynamic behavior of long semiflexible polymer chains in a melt. Starting from previously obtained fully equilibrated high molecular weight polymer melts [{\it Zhang et al.} ACS Macro Lett. 3,…

软凝聚态物质 · 物理学 2016-05-25 Hsiao-Ping Hsu , Kurt Kremer

We investigate the complexation of a highly charged sphere with a long flexible polyelectrolyte, \textit{both negatively charged} in salt free environment. Electroneutrality is insured by the presence of divalent counterions. Using…

软凝聚态物质 · 物理学 2007-05-23 Rene Messina , Christian Holm , Kurt Kremer

A new application of the density matrix renormalization group (DMRG) method to a system composed of an interacting dot coupled to a infinite one dimensional lead is presented. This method enables one to study the influence of the coupling…

介观与纳米尺度物理 · 物理学 2007-05-23 Richard Berkovits

We discuss theoretically and numerically the intramolecular form factor $F(q)$ in dense polymer systems. Following Flory's ideality hypothesis, chains in the melt adopt Gaussian configurations and their form factor is supposed to be given…

软凝聚态物质 · 物理学 2009-11-13 P. Beckrich , A. Johner , A. N. Semenov , S. P. Obukhov , H. Benoit , J. P. Wittmer

We use time-resolved dynamic light scattering to investigate the slow dynamics of a colloidal gel. The final decay of the average intensity autocorrelation function is well described by $g\_2(q,\tau)-1 \sim…

软凝聚态物质 · 物理学 2007-05-23 Agnes Duri , Luca Cipelletti

We study a homogeneously driven granular fluid of hard spheres at intermediate volume fractions and focus on time-delayed correlation functions in the stationary state. Inelastic collisions are modeled by incomplete normal restitution,…

统计力学 · 物理学 2013-05-29 Katharina Vollmayr-Lee , Timo Aspelmeier , Annette Zippelius

Structure and thermodynamics of crystalline membranes are characterized by the long wavelength behavior of the normal-normal correlation function G(q). We calculate G(q) by Monte Carlo and Molecular Dynamics simulations for a quasi-harmonic…

材料科学 · 物理学 2015-05-13 J. H. Los , M. I. Katsnelson , O. V. Yazyev , K. V. Zakharchenko , A. Fasolino

Planar brushes formed by end-grafted semiflexible polyampholyte chains, each chain containing equal number of positively and negatively charged monomers is studied using molecular dynamics simulations. Keeping the length of the chains…

软凝聚态物质 · 物理学 2015-05-13 M. Baratlo , H. Fazli

In this paper, we employ Molecular Dynamics computer simulations to study and compare the statics and dynamics of linear and circular (ring) polymer chains in entangled solutions of different densities. While we confirm that linear chain…

软凝聚态物质 · 物理学 2016-02-17 Negar Nahali , Angelo Rosa

We investigate the growth of dynamic heterogeneity in a glassy hard-sphere mixture for volume fractions up to and including the mode-coupling transition. We use an 80 000 particle system to test a new procedure to evaluate a dynamic…

软凝聚态物质 · 物理学 2015-05-19 Elijah Flenner , Grzegorz Szamel

A weakly charged flexible polyelectrolyte chain in a neutral spherical cavity is analyzed using self-consistent field theory (SCFT) within an explicit solvent model. Assuming the radial symmetry for the system, it is found that the…

软凝聚态物质 · 物理学 2009-11-13 Rajeev Kumar , M. Muthukumar

We present a scaling theory describing the collapse of a homopolymer chain in poor solvent. At time t after the beginning of the collapse, the original Gaussian chain of length N is streamlined to form N/g segments of length R(t), each…

软凝聚态物质 · 物理学 2009-11-07 Cameron F. Abrams , Namkyung Lee , Sergei Obukhov

The light-front wave function of a proton composed of three quarks and a perturbative gluon is computed. This is then used to derive expressions for the color charge density correlator $\langle\rho^a(\vec q_1)\, \rho^b(\vec q_2)\rangle$ at…

高能物理 - 唯象学 · 物理学 2023-08-22 Adrian Dumitru , Risto Paatelainen

Angular correlations in dense solutions and melts of flexible polymer chains are investigated with respect to the distance $r$ between the bonds by comparing quantitative predictions of perturbation calculations with numerical data obtained…

软凝聚态物质 · 物理学 2015-05-14 J. P. Wittmer , A. Johner , S. P. Obukhov , H. Meyer , A. Cavallo , J. Baschnagel

Using the language of the Flory chi parameter, we develop a theory that unifies the treatment of the single-chain structure and the solution thermodynamics of polymers in poor solvents. The structure of a globule and its melting…

软凝聚态物质 · 物理学 2015-06-19 Rui Wang , Zhen-Gang Wang

Recent photoabsorption measurements have revealed a rich fine structure in the collective charge-density excitation spectrum of few-electron quantum dots in the presence of magnetic fields. We have performed systematic computational studies…

介观与纳米尺度物理 · 物理学 2009-10-31 C. A. Ullrich , G. Vignale

We consider a two-dimensional Coulomb gas of positive and negative pointlike unit charges interacting via a logarithmic potential. The density (rather than the charge) correlation functions are studied. In the bulk, the form-factor theory…

统计力学 · 物理学 2007-05-23 L. Šamaj , B. Jancovici