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We show that the average size of self-avoiding polygons (SAP) with a fixed knot is much larger than that of no topological constraint if the excluded volume is small and the number of segments is large. We call it topological swelling. We…

软凝聚态物质 · 物理学 2018-01-17 Erica Uehara , Tetsuo Deguchi

Several nontrivial properties are shown for the mean square radius of gyration $R_K^2$ of ring polymers with a fixed knot type K. Through computer simulation, we discuss both finite-size and asymptotic behaviors of the gyration radius under…

软凝聚态物质 · 物理学 2009-11-07 Miyuki K. Shimamura , Tetsuo Deguchi

Anomalously strong finite-size effects have been observed for the mean square radius of gyration $R^2_K$ of Gaussian random polygons with a fixed knot $K$ as a function of the number $N$ of polygonal nodes. Through computer simulations with…

软凝聚态物质 · 物理学 2009-03-26 Miyuki K. Shimamura , Tetsuo Deguchi

We examine numerically the distribution function $f_K(r)$ of distance $r$ between opposite polygonal nodes for random polygons of $N$ nodes with a fixed knot type $K$. Here we consider three knots such as $\emptyset$, $3_1$ and $3_1 \sharp…

软凝聚态物质 · 物理学 2009-11-10 Akihisa Yao , Hiroshi Tsukahara , Tetsuo Deguchi , Takeo Inami

Let $p_n$ denote the number of self-avoiding polygons of length $n$ on a regular three-dimensional lattice, and let $p_n(K)$ be the number which have knot type $K$. The probability that a random polygon of length $n$ has knot type $K$ is…

统计力学 · 物理学 2015-05-27 E. J. Janse van Rensburg , A. Rechnitzer

Large scale molecular dynamics simulations on graphic processing units (GPUs) are employed to study the scaling behavior of ring polymers with various topological constraints in melts. Typical sizes of rings containing $3_1$, $5_1$ knots…

软凝聚态物质 · 物理学 2015-09-04 Benjamin Trefz , Peter Virnau

We give two different, statistically consistent definitions of the length l of a prime knot tied into a polymer ring. In the good solvent regime the polymer is modelled by a self avoiding polygon of N steps on cubic lattice and l is the…

统计力学 · 物理学 2015-06-25 B. Marcone , E. Orlandini , A. L. Stella , F. Zonta

We present experimental results on knotting in off-lattice self-avoiding polygons in the bead-chain model. Using Clisby's tree data structure and the scale-free pivot algorithm, for each $k$ between $10$ and $27$ we generated $2^{43-k}$…

We consider the probability of knotting in equilateral random polygons in Euclidean 3-dimensional space, which model, for instance, random polymers. Results from an extensive Monte Carlo dataset of random polygons indicate a universal…

统计力学 · 物理学 2022-04-15 A. Xiong , A. J. Taylor , M. R. Dennis , S. G. Whittington

We discuss the probability of random knotting for a model of self-avoiding polygons whose segments are given by cylinders of unit length with radius $r$. We show numerically that the characteristic length of random knotting is roughly…

统计力学 · 物理学 2009-10-31 Miyuki K. shimamura , Tetsuo Deguchi

We study several related models of self-avoiding polygons in a tubular subgraph of the simple cubic lattice, with a particular interest in the asymptotics of the knotting statistics. Polygons in a tube can be characterised by a finite…

统计力学 · 物理学 2020-03-04 Nicholas R. Beaton , Jeremy W. Eng , Christine E. Soteros

We consider the expected value for the total curvature of a random closed polygon. Numerical experiments have suggested that as the number of edges becomes large, the difference between the expected total curvature of a random closed…

It is nontrivial whether the average size of a ring polymer should become smaller or larger under a topological constraint. Making use of some knot invariants, we evaluate numerically the mean square radius of gyration for ring polymers…

统计力学 · 物理学 2016-08-31 Miyuki K. Shimamura , Tetsuo Deguchi

The probability of a random polygon (or a ring polymer) having a knot type $K$ should depend on the complexity of the knot $K$. Through computer simulation using knot invariants, we show that the knotting probability decreases exponentially…

软凝聚态物质 · 物理学 2009-11-07 Miyuki K. Shimamura , Tetsuo Deguchi

We define the knotting probability of a knot $K$ by the probability for a random polygon (RP) or self-avoiding polygon (SAP) of $N$ segments having the knot type $K$. We show fundamental and generic properties of the knotting probability…

软凝聚态物质 · 物理学 2017-10-11 Erica Uehara , Tetsuo Deguchi

Take N sites distributed randomly and uniformly on a smooth closed surface. We express the expected distance <D_k(N)> from an arbitrary point on the surface to its kth-nearest neighboring site, in terms of the function A(l) giving the area…

微分几何 · 数学 2007-05-23 A. G. Percus , O. C. Martin

We consider random trigonometric polynomials of the form \[ f_n(x,y)=\sum_{1\le k,l \le n} a_{k,l} \cos(kx) \cos(ly), \] where the entries $(a_{k,l})_{k,l\ge 1}$ are i.i.d. random variables that are centered with unit variance. We…

概率论 · 数学 2016-10-19 Jürgen Angst , Guillaume Poly , Hung Pham Viet

We consider polymers in which M randomly selected pairs of monomers are restricted to be in contact. Analytical arguments and numerical simulations show that an ideal (Gaussian) chain of N monomers remains expanded as long as M<<N; its mean…

凝聚态物理 · 物理学 2009-10-28 Yacov Kantor , Mehran Kardar

The size of a zero thickness (no excluded volume) polymer ring is shown to scale with chain length $N$ in the same way as the size of the excluded volume (self-avoiding) linear polymer, as $N^{\nu}$, where $\nu \approx 0.588$. The…

软凝聚态物质 · 物理学 2009-10-31 Alexander Yu. Grosberg

We have examined the behaviors of a knotted linear polymer in narrow tubes using Langevin dynamics simulation to investigate the knot localization property in one-dimensional (1D) geometry. We have found that the knot is strongly localized…

软凝聚态物质 · 物理学 2012-06-05 Chihiro H. Nakajima , Takahiro Sakaue
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