Related papers: Intramolecular Form Factor in Dense Polymer System…
An open problem of arithmetic Ramsey theory asks if given a finite $r$-colouring $c:\mathbb{N}\to\{1,...,r\}$ of the natural numbers, there exist $x,y\in \mathbb{N}$ such that $c(xy)=c(x+y)$ apart from the trivial solution $x=y=2$. More…
. We consider three dimensional model of the Gaussian polymer chain in the presence of defects to understand the formation of a polymer aggregate where the aggregate is induced by the defects. The defects are acting as an attractive centres…
In recent past, experiments and simulations have suggested that apart from the solvent friction, friction arising from the protein itself plays an important role in protein folding by affecting the intra-chain loop formation dynamics. This…
A non-Newtonian flow of a polymer melt is discussed. The description of the exponential decrease of the apparent viscosity by the well-known Eyring formula with an activation energy reduction proportional to the shear stress does not take…
We consider quantum particle or Gaussian polymer confinement between two surfaces and in cylinders with sinusoidal undulations. In terms of the variational method, we show that the quantum mechanical wave equations have lower ground state…
We investigate, via computer simulations, the time evolution of the (Boltzmann) entropy of a dense fluid not in local equilibrium. The macrovariables $M$ describing the system are the (empirical) particle density $f=\{f(\un{x},\un{v})\}$…
A Flory theory is constructed for a long polymer ring in a melt of unknotted and non-concatenated rings. The theory assumes that the ring forms an effective annealed branched object and computes its primitive path. It is shown that the…
The nematic ordering in semiflexible polymers with contour length $L$ exceeding their persistence length $\ell_p$ is described by a confinement of the polymers in a cylinder of radius $r_{eff}$ much larger than the radius $r_\rho$, expected…
There is a long-standing anomaly in the ratio of the decay width for $\psi(3770)\to D^0\overline{D^0}$ to that for $\psi(3770)\to D^+D^-$ at the level of $9.5\,\sigma$. A similar anomaly exists for the ratio of $\phi(1020)\to…
We show, via numerical simulations, that the fidelity decay behavior of quasi-integrable systems is strongly dependent on the location of the initial coherent state with respect to the underlying classical phase space. In parallel to…
An off-lattice Monte Carlo algorithm for solutions of equilibrium polymers (EP) is proposed. At low and moderate densities this is shown to reproduce faithfully the (static) properties found recently for flexible linear EP using a lattice…
We study by Molecular Dynamics simulation a dense one-component system of particles confined on a spherical substrate. We more specifically investigate the evolution of the structural and dynamical properties of the system when changing the…
Equilibrium polyethylene crystal structure, cohesive energy, and elastic constants are calculated by density-functional theory applied with a recently proposed density functional (vdW-DF) for general geometries [Phys. Rev. Lett. 92, 246401…
The goal of this article is to study quantitatively the localisation/delocalisation properties of the discrete Gaussian chain with long-range interactions. Specifically, we consider the discrete Gaussian chain of length $N$, with Dirichlet…
The low-temperature thermal properties of dielectric crystals are governed by acoustic excitations with large wavelengths that are well described by plane waves. This is the Debye model, which rests on the assumption that the medium is an…
We numerically study the structure of the interactions occurring in three-dimensional systems of hard spheres at jamming, focusing on the large-scale behavior. Given the fundamental role they play in the configuration of jammed packings, we…
Polymer self-consistent field theory techniques are used to derive quantum density functional theory without the use of the theorems of density functional theory. Instead, a free energy is obtained from a partition function that is…
A lattice model of critical dense polymers is solved exactly on a cylinder with finite circumference. The model is the first member LM(1,2) of the Yang-Baxter integrable series of logarithmic minimal models. The cylinder topology allows for…
This paper is concerned with difficulties encountered by engineers when they attempt to predict the orientation of fibers in the creation of injection molded plastic parts. It is known that Jeffery's equation, which was designed to model a…
We investigate the chain conformation of ring polymers confined to a cylindrical nanochannel using both theoretical analysis and three dimensional Langevin dynamics simulations. We predict that the longitudinal size of a ring polymer scales…