Data assimilation for the Navier–Stokes- equations

The well-posedness of the data assimilation problem for the Navier–Stokes-α equations on a bounded three-dimensional domain is investigated. The data assimilation procedures under consideration are the adjoint method of variational data assimilation (4D-Var) and the method of continuous data assimilation. Concerning the adjoint method the existence of optimal initial conditions with respect to an observation-dependent cost functional is proven, the optimizers are characterized by a first-order necessary condition involving the adjoint linearized Navier–Stokes-α equations and conditions for the uniqueness of the initial conditions are given. Well-posedness of the continuous data assimilation problem is proven and convergence rates in terms of observational resolution are provided.     

Infrared reflectivity of BaMnF4

The polarized reflectivity of BaMnF₄ single crystals was measured in the 20–600 cm^–1 range for temperatures from 10 to 300 K. The results were evaluated using Kramers-Kronig analysis to obtain the dielectric function. The number of active modes in the high temperature polar phase (T>T _i 250K) is in agreement with group-theoretical expectation. In the incommensurate phaseT<T _i the number of active modes increases more than two times. All the results are in reasonable agreement with previous Raman and far infrared data.     

Letter: Solutions of All One-Dimensional Wave Equations with Time Independent Potential and Separable Variables

Solutions, in terms of special functions, of all wave equations u _xx – u _tt = V(x) u(t,x), characterised by eight inequivalent time independent potentials and by variables separation, have been found. The real valueness and the properties of the solutions produced by computer algebra programs are not always manifest and in this work we provide ready to use solutions. We discuss especially the potential (m ₁ + m ₂ sinh x)cosh^–2x. Such potential approximates the Schwarzschild black hole potential and its use for determining black holes quasi-normal modes is hinted to.     

A General-Purpose Finite-Volume Advection Scheme for Continuous and Discontinuous Fields on Unstructured Grids

We present a new general-purpose advection scheme for unstructured meshes based on the use of a variation of the interface-tracking flux formulation recently put forward by O. Ubbink and R. I. Issa (J. Comput. Phys.153, 26 (1999)), in combination with an extended version of the flux-limited advection scheme of J. Thuburn (J. Comput. Phys.123, 74 (1996)), for continuous fields. Thus, along with a high-order mode for continuous fields, the new scheme presented here includes optional integrated interface-tracking modes for discontinuous fields. In all modes, the method is conservative, monotonic, and compatible. It is also highly shape preserving. The scheme works on unstructured meshes composed of any kind of connectivity element, including triangular and quadrilateral elements in two dimensions and tetrahedral and hexahedral elements in three dimensions. The scheme is finite-volume based and is applicable to control-volume finite-element and edge-based node-centered computations. An explicit–implicit extension to the continuous-field scheme is provided only to allow for computations in which the local Courant number exceeds unity. The transition from the explicit mode to the implicit mode is performed locally and in a continuous fashion, providing a smooth hybrid explicit–implicit calculation. Results for a variety of test problems utilizing the continuous and discontinuous advection schemes are presented.     

Photoluminescence asymmetry with quantum state preparation

We show that the number of photons in a strongly coupled exciton–photon system is asymmetric with the detuning of the modes when, in the spontaneous emission regime, the two modes are entangled. As changing the detuning is easy in semiconductor microcavities–where on the other hand the nature of the strong-coupling in terms of single-particle effects is not yet resolved–we propose this effect as a test of the quantum character of microcavity polaritons.     

Drift mobility and kinetics of transport of excess charge carriers in glassy CdGexAs2

Conclusions We tried to measure transient conductivity response to pulse strongly absorbed excitation (light, accelerated electrons) in sandwich type samples of glassy CdGe _x As₂ compounds. We observed the signal due to transport of free excess carriers. From analysis of experimental results we conclude that in our materials strong trapping effects are present, so the range of excited carriers is very short (10^–4-10^–3 cm) even in the highest electrical fields used (to 10⁴ V. cm^–1). Estimates of upper limit of drift mobility give the values 10^–1- 1 cm² V^–1 sec^–1. We did not succeed in determining the type of carriers which are responsible for the observed effects.     

Methyl and t-butyl reorientation in an organic molecular solid

We have determined the molecular and crystal structure of 4,5-dibromo-2,7-di-t-butyl-9,9-dimethylxanthene and measured the ¹H spin–lattice relaxation rate from 87 to 270 K at NMR frequencies of ω/2π=8.50, 22.5, and 53.0 MHz. All molecules in the crystal see the same intra and intermolecular environment and the repeating unit is half a molecule. We have extended models developed for ¹H spin–lattice relaxation resulting from the reorientation of a t-butyl group and its constituent methyl groups to include these rotors and the 9-methyl groups. The relaxation rate data is well-fitted assuming that the t-butyl groups and all three of their constituent methyl groups, as well as the 9-methyl groups all reorient with an NMR activation energy of 15.8±1.6 kJ mol⁻¹ corresponding to a barrier of 17.4±3.2 kJ mol⁻¹. Only intramethyl and intra-t-butyl intermethyl spin–spin interactions need be considered. A unique random-motion Debye (or BPP) spectral density will not fit the data for any reasonable choice of parameters. A distribution of activation energies is required.     

A smooth massless limit for supersymmetric QCD

We analyse in detail the behaviour of supersymmetric QCD with a number of flavours M smaller than the number of colours N, for quark masses smaller than the dynamically generated scale Λ. In this regime, we find it useful to move from meson superfields to Nambu–Goldstone-like variables. In particular we work out the mass spectrum and the set of decay constants that specify the interactions of the low-energy theory. We explicitly check that masses and decay constants have a consistent behaviour under decoupling and that they satisfy current algebra requirements. Finally we speculate about the massless limit. For vanishing quark masses, and only in this case, the relation between mesons and Nambu–Goldstone variables becomes singular. When analysed in terms of the Nambu–Goldstone superfields, the massless limit exhibits a spontaneous breaking of the flavour symmetry, with massless Goldstone modes embedded in an M²-dimensional complex moduli space. The symmetry-breaking order parameter is formally infinite, but this has the only effect of turning off the interactions between the chiral superfields. The massive case, for masses smaller than Λ, can be thought of as a perturbation around the massless case, with corrections that can be systematically computed in the effective theory.     

New fermions ate + e − colliders I. Production and decay

We analyze the production in e⁺e^– collisions of new heavy fermions stemming from extensions of the Standard Model. We write down the most general expression for the production of two heavy fermions and their subsequent decays, allowing for the polarization of thee ⁺ e ^– initial state and taking into account the final polarization of the fermions. We then discuss the various decay modes including cascade and three body decays, and the production mechanisms, both pair production and single production in association with ordinary fermions.     

Theoretical calculations and Raman spectrum of intercalation modes in LixInSe

By using an extended linear-chain model which includes the interlayer forces, we have calculated the new vibrational modes, of Li intercalated InSe. The dispersion curves along thek _z wavevector perpendicular to the layers for the -polytype are determined in the first Brillouin zone. Assuming that the interlayer interaction is not modified upon intercalation and the interaction between lithium atom and adjacent layers in the van der Waals plane has the same value than the interlayer one, the new modes are determined with the force constant given by the rigid layer mode of the, -polytype at 18 cm^–1. This model gives the variation of the acoustic branches and the appearance of two optical intercalation modes at higher frequencies. The Brillouin zone boundary modes of the acoustic branches at 18 and 41 cm^–1 in the pure material are calculated to be 22 and 50 cm^–1 respectively forx=1/2. The dispersion of the new optical branches is flat along thez-direction and frequencies are obtained at 96 cm^–1 for the Li mode perpendicular tok _z and at 218 cm^–1 for the Li mode parallel tok _z. We compare also our results with the Li mode frequencies obtained in a total energy calculation. Raman scattering experiments have been performed in intercalated sample in order to verify the proposed model.     

Scaling and instability analyses on flame spread over liquids

Stability and scaling analyses were applied to experimental data obtained by this group and other researchers on pulsating flame spread over liquids. Data to be analyzed include recent findings of cyclic appearance of a cold temperature valley at the liquid surface-created surface-wave ahead of the spreading flame, and main-pulsation of 0.5–2 Hz and sub-pulsation of 5–10 Hz. Our stability analysis is performed to understand the mechanism of instability on the liquid surface ahead of a flame’s leading edge, which is thought of as the major cause for pulsating flame spread. The scaling analysis is performed to explore the role of four independent (gravity, surface-tension, viscose, and inertia) forces on the mechanisms of flame spread. These four forces form three independent pi-numbers: Marangoni (Ma) number, Weber (We) number, and Froude (Fr) number, all of which include the critical length scale ratio: (height of sub-surface circulation)/(horizontal length of preheated liquid surface). We combined the wave equation obtained from the stability analysis, the three pi-numbers, and the critical length scale ratio, and used them as a universal formula to describe flame spread over liquids. Using this formula, flame spread mechanism over four different types of alcohols was divided into two separate regimes: the thin liquid pool and the thick-liquid pool. For the thin liquid pool, the flame spread rate was correlated with (Fr/Ma^0.5)^−1.0, while for the thick-liquid pool it was correlated with (Fr/Ma^0.5)^−1.5. Change of flame spread pattern from the uniform to the pulsating can be described with temperature difference between the flash point and bulk liquid temperature. For the thin liquid pool this temperature difference is correlated with Ma^−0.5, while for the thick-liquid pool it is correlated with Ma⁻¹. The frequency of pulsation is correlated with We^−1.0 for the thin liquid pool, while it is correlated with We^−1.5 for the thick-liquid pool.     

Sum-frequency spectroscopy of physisorbed and chemisorbed molecules at liquid and solid surfaces using band-width-limited picosecond pulses

We studied the vibrational Sum-Frequency (SF) spectra of long chain fatty alcohols and amines physisorbed at liquid/air interfaces and of OctadecylTrichlorSilan (OTS) chemisorbed on glass/air interfaces in situ, i. e., in normal laboratory environment. The intense, band-width-limited IR pulses generated by our laser system are tunable from 2600 to 4000 cm^–1 with a constant pulse duration of 3 ps and a band width of 5 cm^–1 (FWHM) over the entire tuning range, thus covering the CH-, NH-, and OH-stretching regions.Using suitable polarization geometries, information on the molecular orientation is obtained from the amplitudes of the symmetric and degenerate methyl-stretching modes. Opposite phase of adjacent vibrational modes can lead to destructive interference in the SF signal, as analyzed theoretically. This interference effect is observed experimentally for the first time, due to the superior spectral resolution and signal-to-noise ratio of our spectra.     

On First-order Corrections to the LSW Theory II: Finite Systems

We consider first–order corrections to the classical theory by Lifshitz, Slyozov and Wagner (LSW) for systems with a finite number of particles. Numerical simulations in V. E Fradkov etal. [Phys. Rev. E 53:3925–3932 (1996)] show a cross–over in the scaling of the correction term from ^1/3 to ^1/2 ( is the volume fraction of particles), when the system size becomes larger than the screening length. We rigorously derive this cross–over for the rate of change of the energy, starting from the monopole approximation. The proof exploits the fact that the rate of change of energy has a variational characterization.     

Amorphous to crystalline transition in Dy-Fe thin films

The crystallization of vacuum-deposited amorphous Dy-Fe thin films was studied by transmission electron microscopy and electron diffraction. The effect of thickness, deposition rate and substrate temperature on the crystallization process have been investigated. The results show that the crystallization thicknessd _c decreases with increasing deposition rate and substrate temperature. The number density of Dy-Fe islands were found to be almost constant at (4–5)×10¹¹ cm^–2 in the thickness range 20 Å<d <50 Å. The number density decreases with increase ind _c .     

A variational approach to second-order multisymplectic field theory

This paper presents a geometric-variational approach to continuous and discrete second-order field theories following the methodology of [Marsden, Patrick, Shkoller, Comm. Math. Phys. 199 (1998) 351–395]. Staying entirely in the Lagrangian framework and letting Y denote the configuration fiber bundle, we show that both the multisymplectic structure on J³Y as well as the Noether theorem arise from the first variation of the action function. We generalize the multisymplectic form formula derived for first-order field theories in [Marsden, Patrick, Shkoller, Comm. Math. Phys. 199 (1998) 351–395], to the case of second-order field theories, and we apply our theory to the Camassa–Holm (CH) equation in both the continuous and discrete settings. Our discretization produces a multisymplectic-momentum integrator, a generalization of the Moser–Veselov rigid body algorithm to the setting of nonlinear PDEs with second-order Lagrangians.     

Controlled mixing enhancement in turbulent rectangular jets responding to periodically forced inflow conditions

We present numerical studies of active flow control applied to jet flow. We focus on rectangular jets, which are more unstable than their circular counterparts. The higher level of instability is expressed mainly by an increased intensity of mixing of the main flow with its surroundings. We analyse jets with aspect ratio A_r = 1, A_r = 2 and A_r = 3 at Re = 10,000. It is shown that the application of control with a suitable excitation (forcing) at the jet nozzle can amplify the mixing and qualitatively alter the character of the flow. This can result in an increased spreading rate of the jet or even splitting into nearly separate streams. The excitations studied are obtained from a superposition of axial and flapping forcing terms. We consider the effect of varying parameters such as the frequency of the excitations and phase shift between forcing components. The amplitude of the forcing is 10% of the inlet centreline jet velocity and the forcing frequencies correspond to Strouhal numbers in a range St = 0.3–0.7. It is shown that qualitatively different flow regimes and a rich variety of possible flow behaviours can be achieved simply by changing aspect ratio and forcing parameters. The numerical results are obtained applying large eddy simulation in combination with a high-order compact difference code for incompressible flows. The solutions are validated based on experimental data from literature for non-excited jets for A_r = 1 at Re = 1.84 × 10⁵ and A_r = 2 at Re = 1.28 × 10⁵. Both the mean velocities as well as their fluctuations are predicted with good accuracy.     

Apparent conflicting indications on the conformation of dimethylether–argon from the rotational spectra of the d6 and C species

The rotational spectra of dimethylether–d₆–Ar and dimethylether–¹³C–Ar have been investigated by molecular beam Fourier transform microwave spectroscopy. The obtained rotational constants, when compared to those of the normal species, give contrasting indications on the conformation of the complex. We believe the indications given by the dimethylether–Ar/dimethylether–¹³C–Ar pair to be the correct ones. They suggest the Ar atom to lie in the σ_ν symmetry plane of dimethylether perpendicular to the C–O–C plane, shifted towards the oxygen atom. This conformation is in agreement with several kinds of theoretical calculations. Probably isotopic substitution effects make the data from dimethylether–d₆–Ar not directly compatible with those of the other species.     

Far-infrared spectra of Pb1−xMnxTe alloys

Far-infrared reflectivity spectra of Pb_1−xMn_xTe (0.0001x0.1) single crystals were measured in the 10–250 cm⁻¹ range at room temperature. The analysis of the far-infrared spectra was made by a fitting procedure based on the model of coupled oscillators. In spite of the strong plasmon–LO phonon interaction, we found that the long wavelength optical phonon modes of these mixed crystals showed an intermediate one–two mode behavior.     

Microwave and low-frequency vibrational spectra of bullvalene

The microwave spectrum of bullvalene has been investigated in the region 18–40 GHz. In addition to transitions in the ground vibrational state, transitions arising from five excited vibrational states below 600 cm⁻¹ have also been observed. A combination of microwave intensity measurements and infrared and Raman data has been utilized to assign these vibrations. Three of the vibrations are E-type modes at 241, 355, and 588 cm⁻¹. One is an A₁-type mode at 445 cm⁻¹, and another is an A₂-type at 266 cm⁻¹. The microwave spectrum indicates the presence of a first-order Coriolis interaction for the E modes at 241 and 588 cm⁻¹. The first-order Coriolis coupling constant q = 0.557 MHz for the 241 cm⁻¹ vibration. The spectral results are consistent with C_3v symmetry for bullvalene.     

Boundary G/G Theory and Topological Poisson–Lie Sigma Model

We study a boundary version of the gauged WZW model with a Poisson–Lie group G as the target. The Poisson–Lie structure of G is used to define the Wess–Zumino term of the action on surfaces with boundary. We clarify the relation of the model to the topological Poisson sigma model with the dual Poisson–Lie group G ^* as the target and show that the phase space of the theory on a strip is essentially the Heisenberg double of G introduced by Semenov–Tian–Shansky.