Hypergeometric representation of a four-loop vacuum bubble

In this article, we present a new analytic result for a certain single-mass-scale four-loop vacuum (bubble) integral. We also discuss its systematic \e-expansion in d=4-2\e as well as d=3-2\e dimensions, the coefficients of which are expressible in terms of harmonic sums at infinity.Comment: 5 pages, to appear in the proceedings of the conference "Loops and Legs", Eisenach, 200

Nature and strength of bonding in a crystal of semiconducting nanotubes: van der Waals density functional calculations and analytical results

The dispersive interaction between nanotubes is investigated through ab initio theory calculations and in an analytical approximation. A van der Waals density functional (vdW-DF) [Phys. Rev. Lett. 92, 246401 (2004)] is used to determine and compare the binding of a pair of nanotubes as well as in a nanotube crystal. To analyze the interaction and determine the importance of morphology, we furthermore compare results of our ab initio calculations with a simple analytical result that we obtain for a pair of well-separated nanotubes. In contrast to traditional density functional theory calculations, the vdW-DF study predicts an intertube vdW bonding with a strength that is consistent with recent observations for the interlayer binding in graphitics. It also produce a nanotube wall-to-wall separation which is in very good agreement with experiments. Moreover, we find that the vdW-DF result for the nanotube-crystal binding energy can be approximated by a sum of nanotube-pair interactions when these are calculated in vdW-DF. This observation suggests a framework for an efficient implementation of quantum-physical modeling of the CNT bundling in more general nanotube bundles, including nanotube yarn and rope structures.Comment: 10 pages, 4 figure

Shortcomings of the Bond Orientational Order Parameters for the Analysis of Disordered Particulate Matter

Local structure characterization with the bond-orientational order parameters q4, q6, ... introduced by Steinhardt et al. has become a standard tool in condensed matter physics, with applications including glass, jamming, melting or crystallization transitions and cluster formation. Here we discuss two fundamental flaws in the definition of these parameters that significantly affect their interpretation for studies of disordered systems, and offer a remedy. First, the definition of the bond-orientational order parameters considers the geometrical arrangement of a set of neighboring spheres NN(p) around a given central particle p; we show that procedure to select the spheres constituting the neighborhood NN(p) can have greater influence on both the numerical values and qualitative trend of ql than a change of the physical parameters, such as packing fraction. Second, the discrete nature of neighborhood implies that NN(p) is not a continuous function of the particle coordinates; this discontinuity, inherited by ql, leads to a lack of robustness of the ql as structure metrics. Both issues can be avoided by a morphometric approach leading to the robust Minkowski structure metrics ql'. These ql' are of a similar mathematical form as the conventional bond-orientational order parameters and are mathematically equivalent to the recently introduced Minkowski tensors [Europhys. Lett. 90, 34001 (2010); Phys. Rev. E. 85, 030301 (2012)]

Geometric, Variational Integrators for Computer Animation

We present a general-purpose numerical scheme for time integration of Lagrangian dynamical systems—an important computational tool at the core of most physics-based animation techniques. Several features make this particular time integrator highly desirable for computer animation: it numerically preserves important invariants, such as linear and angular momenta; the symplectic nature of the integrator also guarantees a correct energy behavior, even when dissipation and external forces are added; holonomic constraints can also be enforced quite simply; finally, our simple methodology allows for the design of high-order accurate schemes if needed. Two key properties set the method apart from earlier approaches. First, the nonlinear equations that must be solved during an update step are replaced by a minimization of a novel functional, speeding up time stepping by more than a factor of two in practice. Second, the formulation introduces additional variables that provide key flexibility in the implementation of the method. These properties are achieved using a discrete form of a general variational principle called the Pontryagin-Hamilton principle, expressing time integration in a geometric manner. We demonstrate the applicability of our integrators to the simulation of non-linear elasticity with implementation details

Space-resolved dynamics of a tracer in a disordered solid

The dynamics of a tracer particle in a glassy matrix of obstacles displays slow complex transport as the free volume approaches a critical value and the void space falls apart. We investigate the emerging subdiffusive motion of the test particle by extensive molecular dynamics simulations and characterize the spatio-temporal transport in terms of two-time correlation functions, including the time-dependent diffusion coefficient as well as the wavenumber-dependent intermediate scattering function. We rationalize our findings within the framework of critical phenomena and compare our data to a dynamic scaling theory.Comment: 10 pages, 7 figures, submitted to Journal of Non-Crystalline Solid

Recurrent proofs of the irrationality of certain trigonometric values

We use recurrences of integrals to give new and elementary proofs of the irrationality of pi, tan(r) for all nonzero rational r, and cos(r) for all nonzero rational r^2. Immediate consequences to other values of the elementary transcendental functions are also discussed

Group Theory of Chiral Photonic Crystals with 4-fold Symmetry: Band Structure and S-Parameters of Eight-Fold Intergrown Gyroid Nets

The Single Gyroid, or srs, nanostructure has attracted interest as a circular-polarisation sensitive photonic material. We develop a group theoretical and scattering matrix method, applicable to any photonic crystal with symmetry I432, to demonstrate the remarkable chiral-optical properties of a generalised structure called 8-srs, obtained by intergrowth of eight equal-handed srs nets. Exploiting the presence of four-fold rotations, Bloch modes corresponding to the irreducible representations E- and E+ are identified as the sole and non-interacting transmission channels for right- and left-circularly polarised light, respectively. For plane waves incident on a finite slab of the 8-srs, the reflection rates for both circular polarisations are identical for all frequencies and transmission rates are identical up to a critical frequency below which scattering in the far field is restricted to zero grating order. Simulations show the optical activity of the lossless dielectric 8-srs to be large, comparable to metallic metamaterials, demonstrating its potential as a nanofabricated photonic material

Group Theory of Circular-Polarization Effects in Chiral Photonic Crystals with Four-Fold Rotation Axes, Applied to the Eight-Fold Intergrowth of Gyroid Nets

We use group or representation theory and scattering matrix calculations to derive analytical results for the band structure topology and the scattering parameters, applicable to any chiral photonic crystal with body-centered cubic symmetry I432 for circularly-polarised incident light. We demonstrate in particular that all bands along the cubic [100] direction can be identified with the irreducible representations E+/-,A and B of the C4 point group. E+ and E- modes represent the only transmission channels for plane waves with wave vector along the ? line, and can be identified as non-interacting transmission channels for right- (E-) and left-circularly polarised light (E+), respectively. Scattering matrix calculations provide explicit relationships for the transmission and reflectance amplitudes through a finite slab which guarantee equal transmission rates for both polarisations and vanishing ellipticity below a critical frequency, yet allowing for finite rotation of the polarisation plane. All results are verified numerically for the so-called 8-srs geometry, consisting of eight interwoven equal-handed dielectric Gyroid networks embedded in air. The combination of vanishing losses, vanishing ellipticity, near-perfect transmission and optical activity comparable to that of metallic meta-materials makes this geometry an attractive design for nanofabricated photonic materials