Sample records for leading order approximation

  1. Construction and accuracy of partial differential equation approximations to the chemical master equation.

    PubMed

    Grima, Ramon

    2011-11-01

    The mesoscopic description of chemical kinetics, the chemical master equation, can be exactly solved in only a few simple cases. The analytical intractability stems from the discrete character of the equation, and hence considerable effort has been invested in the development of Fokker-Planck equations, second-order partial differential equation approximations to the master equation. We here consider two different types of higher-order partial differential approximations, one derived from the system-size expansion and the other from the Kramers-Moyal expansion, and derive the accuracy of their predictions for chemical reactive networks composed of arbitrary numbers of unimolecular and bimolecular reactions. In particular, we show that the partial differential equation approximation of order Q from the Kramers-Moyal expansion leads to estimates of the mean number of molecules accurate to order Ω(-(2Q-3)/2), of the variance of the fluctuations in the number of molecules accurate to order Ω(-(2Q-5)/2), and of skewness accurate to order Ω(-(Q-2)). We also show that for large Q, the accuracy in the estimates can be matched only by a partial differential equation approximation from the system-size expansion of approximate order 2Q. Hence, we conclude that partial differential approximations based on the Kramers-Moyal expansion generally lead to considerably more accurate estimates in the mean, variance, and skewness than approximations of the same order derived from the system-size expansion.

  2. Representation of the exact relativistic electronic Hamiltonian within the regular approximation

    NASA Astrophysics Data System (ADS)

    Filatov, Michael; Cremer, Dieter

    2003-12-01

    The exact relativistic Hamiltonian for electronic states is expanded in terms of energy-independent linear operators within the regular approximation. An effective relativistic Hamiltonian has been obtained, which yields in lowest order directly the infinite-order regular approximation (IORA) rather than the zeroth-order regular approximation method. Further perturbational expansion of the exact relativistic electronic energy utilizing the effective Hamiltonian leads to new methods based on ordinary (IORAn) or double [IORAn(2)] perturbation theory (n: order of expansion), which provide improved energies in atomic calculations. Energies calculated with IORA4 and IORA3(2) are accurate up to c-20. Furthermore, IORA is improved by using the IORA wave function to calculate the Rayleigh quotient, which, if minimized, leads to the exact relativistic energy. The outstanding performance of this new IORA method coined scaled IORA is documented in atomic and molecular calculations.

  3. Computational aspects of pseudospectral Laguerre approximations

    NASA Technical Reports Server (NTRS)

    Funaro, Daniele

    1989-01-01

    Pseudospectral approximations in unbounded domains by Laguerre polynomials lead to ill-conditioned algorithms. Introduced are a scaling function and appropriate numerical procedures in order to limit these unpleasant phenomena.

  4. Resumming the large-N approximation for time evolving quantum systems

    NASA Astrophysics Data System (ADS)

    Mihaila, Bogdan; Dawson, John F.; Cooper, Fred

    2001-05-01

    In this paper we discuss two methods of resumming the leading and next to leading order in 1/N diagrams for the quartic O(N) model. These two approaches have the property that they preserve both boundedness and positivity for expectation values of operators in our numerical simulations. These approximations can be understood either in terms of a truncation to the infinitely coupled Schwinger-Dyson hierarchy of equations, or by choosing a particular two-particle irreducible vacuum energy graph in the effective action of the Cornwall-Jackiw-Tomboulis formalism. We confine our discussion to the case of quantum mechanics where the Lagrangian is L(x,ẋ)=(12)∑Ni=1x˙2i-(g/8N)[∑Ni=1x2i- r20]2. The key to these approximations is to treat both the x propagator and the x2 propagator on similar footing which leads to a theory whose graphs have the same topology as QED with the x2 propagator playing the role of the photon. The bare vertex approximation is obtained by replacing the exact vertex function by the bare one in the exact Schwinger-Dyson equations for the one and two point functions. The second approximation, which we call the dynamic Debye screening approximation, makes the further approximation of replacing the exact x2 propagator by its value at leading order in the 1/N expansion. These two approximations are compared with exact numerical simulations for the quantum roll problem. The bare vertex approximation captures the physics at large and modest N better than the dynamic Debye screening approximation.

  5. Excited heavy baryons and their symmetries III: Phenomenology

    NASA Astrophysics Data System (ADS)

    Baccouche, Z. Aziza; Chow, Chi-Keung; Cohen, Thomas D.; Gelman, Boris A.

    2001-12-01

    Phenomenological applications of an effective theory of low-lying excited states of charm and bottom isoscalar baryons are discussed at leading and next-to-leading order in the combined heavy-quark and large- Nc expansion. The combined expansion is formulated in terms of the counting parameter λ˜1/ mQ,1/ Nc; the combined expansion is in powers of λ1/2. We work up to next-to-leading order. We obtain model-independent predictions for the excitation energies, the semileptonic form factors and electromagnetic decay rates. At leading order in the combined expansion these observables are given in terms of one phenomenological constant which can be determined from the excitation energy of the first excited state of Λc baryon. At next-to-leading order an additional phenomenological constant is required. The spin-averaged mass of the doublet of the first orbitally excited state of Λb is predicted to be approximately 5920 MeV. It is shown that in the combined limit at leading and next-to-leading order there is only one independent form factor describing Λ b→Λ cℓ ν¯; similarly, Λ b→Λ c∗ℓ ν¯ and Λ b→Λ c1ℓ ν¯ decays are described by a single independent form factor. These form factors are calculated at leading and next-to-leading order in the combined expansion. The value of the Λ b→Λ cℓ ν¯ form factor at zero recoil is predicted to be 0.998 at leading order which is very close to HQET value of unity. The electromagnetic decay rates of the first excited states of Λc and Λb are determined at leading and next-to-leading order. The ratio of radiative decay rates Γ(Λ c∗→Λ cγ)/Γ(Λ b1→Λ bγ) is predicted to be approximately 0.2, greatly different from the heavy-quark effective theory value of unity.

  6. The three-dimensional shape of serrations at barn owl wings: towards a typical natural serration as a role model for biomimetic applications

    PubMed Central

    Bachmann, Thomas; Wagner, Hermann

    2011-01-01

    Barn owl feathers at the leading edge of the wing are equipped with comb-like structures termed serrations on their outer vanes. Each serration is formed by one barb ending that separates and bends upwards. This structure is considered to play a role in air-flow control and noise reduction during flight. Hence, it has considerable potential for engineering applications, particularly in the aviation industry. Several publications have reported possible functions of serrations at artificial airfoils. However, only crude approximations of natural serrations have so far been investigated. We refer to these attempts as zero-order approximations of serrations. It was the goal of this study to present a quantitative three-dimensional characterization of natural serrations as first-order approximations (mean values) and second-order approximations (listed differences depending on the position of the serration along the leading edge). Confocal laser scanning microscopy was used for a three-dimensional reconstruction and investigation with high spatial resolution. Each serration was defined by its length, profile geometry and curvature. Furthermore, the orientation of the serrations at the leading edge was characterized by the inclination angle, the tilt angle and the separation distance of neighboring serrations. These data are discussed with respect to possible applications of serration-like structures for noise suppression and air-flow control. PMID:21507001

  7. On High-Order Radiation Boundary Conditions

    NASA Technical Reports Server (NTRS)

    Hagstrom, Thomas

    1995-01-01

    In this paper we develop the theory of high-order radiation boundary conditions for wave propagation problems. In particular, we study the convergence of sequences of time-local approximate conditions to the exact boundary condition, and subsequently estimate the error in the solutions obtained using these approximations. We show that for finite times the Pade approximants proposed by Engquist and Majda lead to exponential convergence if the solution is smooth, but that good long-time error estimates cannot hold for spatially local conditions. Applications in fluid dynamics are also discussed.

  8. Triviality of Quantum Electrodynamics Revisited

    NASA Astrophysics Data System (ADS)

    Djukanovic, D.; Gegelia, J.; Meißner, Ulf-G.

    2018-03-01

    Quantum electrodynamics is often considered to be a trivial theory. This is based on a number of evidences, both numerical and analytical. One of the strong indications for triviality of QED is the existence of the Landau pole for the running coupling. We show that by treating QED as the leading order approximation of an effective field theory and including the next-to-leading order corrections, the Landau pole is removed. We also analyze the cutoff dependence of the bare coupling at two-loop order and conclude that the conjecture, that for reasons of self-consistency, QED needs to be trivial is a mere artefact of the leading order approximation to the corresponding effective field theory. Supported in part by DFG and NSFC through funds provided to the Sino-German CRC 110 “Symmetries and the Emergence of Structure in QCD” National Natural Science Foundation of under Grant No. 11621131001, DFG under Grant No. TRR110, the Georgian Shota Rustaveli National Science Foundation (Grant FR/417/6-100/14) and the Chinese Academy of Sciences President’s International Fellowship Initiative (PIFI) under Grant No. 2017VMA0025

  9. Regge vertex for quark production in the central rapidity region in the next-to-leading order

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Kozlov, M. G., E-mail: M.G.Kozlov@inp.nsk.su; Reznichenko, A. V., E-mail: A.V.Reznichenko@inp.nsk.su

    2016-03-15

    The effective vertex for quark production in the interaction of a Reggeized quark and a Reggeized gluon is calculated in the next-to-leading order (NLO). The resulting vertex is the missing component of the NLO multi-Regge amplitude featuring quark and gluon exchanges in the t channels. This calculation will make it possible to develop in future the bootstrap approach to proving quark Reggeization in the next-to-leading logarithmic approximation.

  10. Angular correlations in pair production at the LHC in the parton Reggeization approach

    NASA Astrophysics Data System (ADS)

    Karpishkov, Anton; Nefedov, Maxim; Saleev, Vladimir

    2017-10-01

    We calculate angular correlation spectra between beauty (B) and anti-beauty mesons in proton-proton collisions in the leading order approximation of the parton Reggeization approach consistently merged with the next-to-leading order corrections from the emission of additional hard gluon (NLO* approximation). To describe b-quark hadronization we use the universal scale-depended parton-to-meson fragmentation functions extracted from the combined e+e- annihilation data. The Kimber-Martin-Ryskin model for the unintegrated parton distribution functions in a proton is implied. We have obtained good agreement between our predictions and data from the CMS Collaboration at the energy TeV for angular correlations within uncertainties and without free parameters.

  11. Second-order (2 +1 ) -dimensional anisotropic hydrodynamics

    NASA Astrophysics Data System (ADS)

    Bazow, Dennis; Heinz, Ulrich; Strickland, Michael

    2014-11-01

    We present a complete formulation of second-order (2 +1 ) -dimensional anisotropic hydrodynamics. The resulting framework generalizes leading-order anisotropic hydrodynamics by allowing for deviations of the one-particle distribution function from the spheroidal form assumed at leading order. We derive complete second-order equations of motion for the additional terms in the macroscopic currents generated by these deviations from their kinetic definition using a Grad-Israel-Stewart 14-moment ansatz. The result is a set of coupled partial differential equations for the momentum-space anisotropy parameter, effective temperature, the transverse components of the fluid four-velocity, and the viscous tensor components generated by deviations of the distribution from spheroidal form. We then perform a quantitative test of our approach by applying it to the case of one-dimensional boost-invariant expansion in the relaxation time approximation (RTA) in which case it is possible to numerically solve the Boltzmann equation exactly. We demonstrate that the second-order anisotropic hydrodynamics approach provides an excellent approximation to the exact (0+1)-dimensional RTA solution for both small and large values of the shear viscosity.

  12. Uniform analytic approximation of Wigner rotation matrices

    NASA Astrophysics Data System (ADS)

    Hoffmann, Scott E.

    2018-02-01

    We derive the leading asymptotic approximation, for low angle θ, of the Wigner rotation matrix elements, dm1m2 j(θ ) , uniform in j, m1, and m2. The result is in terms of a Bessel function of integer order. We numerically investigate the error for a variety of cases and find that the approximation can be useful over a significant range of angles. This approximation has application in the partial wave analysis of wavepacket scattering.

  13. Higher-order force moments of active particles

    NASA Astrophysics Data System (ADS)

    Nasouri, Babak; Elfring, Gwynn J.

    2018-04-01

    Active particles moving through fluids generate disturbance flows due to their activity. For simplicity, the induced flow field is often modeled by the leading terms in a far-field approximation of the Stokes equations, whose coefficients are the force, torque, and stresslet (zeroth- and first-order force moments) of the active particle. This level of approximation is quite useful, but may also fail to predict more complex behaviors that are observed experimentally. In this study, to provide a better approximation, we evaluate the contribution of the second-order force moments to the flow field and, by reciprocal theorem, present explicit formulas for the stresslet dipole, rotlet dipole, and potential dipole for an arbitrarily shaped active particle. As examples of this method, we derive modified Faxén laws for active spherical particles and resolve higher-order moments for active rod-like particles.

  14. Comment on “Single-inclusive jet production in electron–nucleon collisions through next-to-next-to-leading order in perturbative QCD” [Phys. Lett. B 763 (2016) 52–59

    DOE PAGES

    Bodwin, Geoffrey T.; Braaten, Eric

    2017-03-22

    In the cross section for single-inclusive jet production in electron nucleon collisions, the distribution of a quark in an electron appears at next-to-next-to-leading order. The numerical calculations in Ref. [1] were carried out using a perturbative approximation for the distribution of a quark in an electron. We point out that that distribution receives nonperturbative QCD contributions that invalidate the perturbative approximation. Here, those nonperturbative effects enter into cross sections for hard-scattering processes through resolved-electron contributions and can be taken into account by determining the distribution of a quark in an electron phenomenologically.

  15. Comment on “Single-inclusive jet production in electron–nucleon collisions through next-to-next-to-leading order in perturbative QCD” [Phys. Lett. B 763 (2016) 52–59

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Bodwin, Geoffrey T.; Braaten, Eric

    In the cross section for single-inclusive jet production in electron nucleon collisions, the distribution of a quark in an electron appears at next-to-next-to-leading order. The numerical calculations in Ref. [1] were carried out using a perturbative approximation for the distribution of a quark in an electron. We point out that that distribution receives nonperturbative QCD contributions that invalidate the perturbative approximation. Here, those nonperturbative effects enter into cross sections for hard-scattering processes through resolved-electron contributions and can be taken into account by determining the distribution of a quark in an electron phenomenologically.

  16. Time-stable boundary conditions for finite-difference schemes solving hyperbolic systems: Methodology and application to high-order compact schemes

    NASA Technical Reports Server (NTRS)

    Carpenter, Mark H.; Gottlieb, David; Abarbanel, Saul

    1993-01-01

    We present a systematic method for constructing boundary conditions (numerical and physical) of the required accuracy, for compact (Pade-like) high-order finite-difference schemes for hyperbolic systems. First, a roper summation-by-parts formula is found for the approximate derivative. A 'simultaneous approximation term' (SAT) is then introduced to treat the boundary conditions. This procedure leads to time-stable schemes even in the system case. An explicit construction of the fourth-order compact case is given. Numerical studies are presented to verify the efficacy of the approach.

  17. Higgs boson production via vector-boson fusion at next-to-next-to-leading order in QCD.

    PubMed

    Bolzoni, Paolo; Maltoni, Fabio; Moch, Sven-Olaf; Zaro, Marco

    2010-07-02

    We present the total cross sections at next-to-next-to-leading order in the strong coupling for Higgs boson production via weak-boson fusion. Our results are obtained via the structure function approach, which builds upon the approximate, though very accurate, factorization of the QCD corrections between the two quark lines. The theoretical uncertainty on the total cross sections at the LHC from higher order corrections and the parton distribution uncertainties are estimated at the 2% level each for a wide range of Higgs boson masses.

  18. Breakdown of the single-exchange approximation in third-order symmetry-adapted perturbation theory.

    PubMed

    Lao, Ka Un; Herbert, John M

    2012-03-22

    We report third-order symmetry-adapted perturbation theory (SAPT) calculations for several dimers whose intermolecular interactions are dominated by induction. We demonstrate that the single-exchange approximation (SEA) employed to derive the third-order exchange-induction correction (E(exch-ind)((30))) fails to quench the attractive nature of the third-order induction (E(ind)((30))), leading to one-dimensional potential curves that become attractive rather than repulsive at short intermolecular separations. A scaling equation for (E(exch-ind)((30))), based on an exact formula for the first-order exchange correction, is introduced to approximate exchange effects beyond the SEA, and qualitatively correct potential energy curves that include third-order induction are thereby obtained. For induction-dominated systems, our results indicate that a "hybrid" SAPT approach, in which a dimer Hartree-Fock calculation is performed in order to obtain a correction for higher-order induction, is necessary not only to obtain quantitative binding energies but also to obtain qualitatively correct potential energy surfaces. These results underscore the need to develop higher-order exchange-induction formulas that go beyond the SEA. © 2012 American Chemical Society

  19. Low-dimensional Representation of Error Covariance

    NASA Technical Reports Server (NTRS)

    Tippett, Michael K.; Cohn, Stephen E.; Todling, Ricardo; Marchesin, Dan

    2000-01-01

    Ensemble and reduced-rank approaches to prediction and assimilation rely on low-dimensional approximations of the estimation error covariances. Here stability properties of the forecast/analysis cycle for linear, time-independent systems are used to identify factors that cause the steady-state analysis error covariance to admit a low-dimensional representation. A useful measure of forecast/analysis cycle stability is the bound matrix, a function of the dynamics, observation operator and assimilation method. Upper and lower estimates for the steady-state analysis error covariance matrix eigenvalues are derived from the bound matrix. The estimates generalize to time-dependent systems. If much of the steady-state analysis error variance is due to a few dominant modes, the leading eigenvectors of the bound matrix approximate those of the steady-state analysis error covariance matrix. The analytical results are illustrated in two numerical examples where the Kalman filter is carried to steady state. The first example uses the dynamics of a generalized advection equation exhibiting nonmodal transient growth. Failure to observe growing modes leads to increased steady-state analysis error variances. Leading eigenvectors of the steady-state analysis error covariance matrix are well approximated by leading eigenvectors of the bound matrix. The second example uses the dynamics of a damped baroclinic wave model. The leading eigenvectors of a lowest-order approximation of the bound matrix are shown to approximate well the leading eigenvectors of the steady-state analysis error covariance matrix.

  20. A stable second order method for training back propagation networks

    NASA Technical Reports Server (NTRS)

    Nachtsheim, Philip R.

    1993-01-01

    A simple method for improving the learning rate of the back-propagation algorithm is described. The basis of the method is that approximate second order corrections can be incorporated in the output units. The extended method leads to significant improvements in the convergence rate.

  1. Second order nonlinear QED processes in ultra-strong laser fields

    NASA Astrophysics Data System (ADS)

    Mackenroth, Felix

    2017-10-01

    In the interaction of ultra-intense laser fields with matter the ever increasing peak laser intensities render nonlinear QED effects ever more important. For long, ultra-intense laser pulses scattering large systems, like a macroscopic plasma, the interaction time can be longer than the scattering time, leading to multiple scatterings. These are usually approximated as incoherent cascades of single-vertex processes. Under certain conditions, however, this common cascade approximation may be insufficient, as it disregards several effects such as coherent processes, quantum interferences or pulse shape effects. Quantifying deviations of the full amplitude of multiple scatterings from the commonly employed cascade approximations is a formidable, yet unaccomplished task. In this talk we are going to discuss how to compute second order nonlinear QED amplitudes and relate them to the conventional cascade approximation. We present examples for typical second order processes and benchmark the full result against common approximations. We demonstrate that the approximation of multiple nonlinear QED scatterings as a cascade of single interactions has certain limitations and discuss these limits in light of upcoming experimental tests.

  2. Cooperative SIS epidemics can lead to abrupt outbreaks

    NASA Astrophysics Data System (ADS)

    Ghanbarnejad, Fakhteh; Chen, Li; Cai, Weiran; Grassberger, Peter

    2015-03-01

    In this paper, we study spreading of two cooperative SIS epidemics in mean field approximations and also within an agent based framework. Therefore we investigate dynamics on different topologies like Erdos-Renyi networks and regular lattices. We show that cooperativity of two diseases can lead to strongly first order outbreaks, while the dynamics still might present some scaling laws typical for second order phase transitions. We argue how topological network features might be related to this interesting hybrid behaviors.

  3. Dense grid sibling frames with linear phase filters

    NASA Astrophysics Data System (ADS)

    Abdelnour, Farras

    2013-09-01

    We introduce new 5-band dyadic sibling frames with dense time-frequency grid. Given a lowpass filter satisfying certain conditions, the remaining filters are obtained using spectral factorization. The analysis and synthesis filterbanks share the same lowpass and bandpass filters but have different and oversampled highpass filters. This leads to wavelets approximating shift-invariance. The filters are FIR, have linear phase, and the resulting wavelets have vanishing moments. The filters are designed using spectral factorization method. The proposed method leads to smooth limit functions with higher approximation order, and computationally stable filterbanks.

  4. Next-to-leading-order QCD corrections to Higgs boson production plus three jets in gluon fusion.

    PubMed

    Cullen, G; van Deurzen, H; Greiner, N; Luisoni, G; Mastrolia, P; Mirabella, E; Ossola, G; Peraro, T; Tramontano, F

    2013-09-27

    We report on the calculation of the cross section for Higgs boson production in association with three jets via gluon fusion, at next-to-leading-order (NLO) accuracy in QCD, in the infinite top-mass approximation. After including the complete NLO QCD corrections, we observe a strong reduction in the scale dependence of the result, and an increased steepness in the transverse momentum distributions of both the Higgs boson and the leading jets. The results are obtained with the combined use of GOSAM, SHERPA, and the MADDIPOLE-MADEVENT framework.

  5. Continuum strong-coupling expansion of Yang-Mills theory: quark confinement and infra-red slavery

    NASA Astrophysics Data System (ADS)

    Mansfield, Paul

    1994-04-01

    We solve Schrödinger's equation for the ground-state of four-dimensional Yang-Mills theory as an expansion in inverse powers of the coupling. Expectation values computed with the leading-order approximation are reduced to a calculation in two-dimensional Yang-Mills theory which is known to confine. Consequently the Wilson loop in the four-dimensional theory obeys an area law to leading order and the coupling becomes infinite as the mass scale goes to zero.

  6. A refinement of the combination equations for evaporation

    USGS Publications Warehouse

    Milly, P.C.D.

    1991-01-01

    Most combination equations for evaporation rely on a linear expansion of the saturation vapor-pressure curve around the air temperature. Because the temperature at the surface may differ from this temperature by several degrees, and because the saturation vapor-pressure curve is nonlinear, this approximation leads to a certain degree of error in those evaporation equations. It is possible, however, to introduce higher-order polynomial approximations for the saturation vapor-pressure curve and to derive a family of explicit equations for evaporation, having any desired degree of accuracy. Under the linear approximation, the new family of equations for evaporation reduces, in particular cases, to the combination equations of H. L. Penman (Natural evaporation from open water, bare soil and grass, Proc. R. Soc. London, Ser. A193, 120-145, 1948) and of subsequent workers. Comparison of the linear and quadratic approximations leads to a simple approximate expression for the error associated with the linear case. Equations based on the conventional linear approximation consistently underestimate evaporation, sometimes by a substantial amount. ?? 1991 Kluwer Academic Publishers.

  7. 78 FR 68107 - Order Exempting Broker-Dealers Participating in the Proposed Global Offering of Meridian Energy...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-11-13

    ... Macquarie Capital (New Zealand) Limited/Macquarie Securities (NZ) Limited (together, ``Joint Lead Managers... that the gross proceeds of the Proposed Global Offering will be approximately NZ$2.5 billion (approximately US$2.0 billion using the NZ$/US$ exchange rate as of July 29, 2013); 3. No more than 20% of the...

  8. QmeQ 1.0: An open-source Python package for calculations of transport through quantum dot devices

    NASA Astrophysics Data System (ADS)

    Kiršanskas, Gediminas; Pedersen, Jonas Nyvold; Karlström, Olov; Leijnse, Martin; Wacker, Andreas

    2017-12-01

    QmeQ is an open-source Python package for numerical modeling of transport through quantum dot devices with strong electron-electron interactions using various approximate master equation approaches. The package provides a framework for calculating stationary particle or energy currents driven by differences in chemical potentials or temperatures between the leads which are tunnel coupled to the quantum dots. The electronic structures of the quantum dots are described by their single-particle states and the Coulomb matrix elements between the states. When transport is treated perturbatively to lowest order in the tunneling couplings, the possible approaches are Pauli (classical), first-order Redfield, and first-order von Neumann master equations, and a particular form of the Lindblad equation. When all processes involving two-particle excitations in the leads are of interest, the second-order von Neumann approach can be applied. All these approaches are implemented in QmeQ. We here give an overview of the basic structure of the package, give examples of transport calculations, and outline the range of applicability of the different approximate approaches.

  9. Higgs Boson Pair Production in Gluon Fusion at Next-to-Leading Order with Full Top-Quark Mass Dependence.

    PubMed

    Borowka, S; Greiner, N; Heinrich, G; Jones, S P; Kerner, M; Schlenk, J; Schubert, U; Zirke, T

    2016-07-01

    We present the calculation of the cross section and invariant mass distribution for Higgs boson pair production in gluon fusion at next-to-leading order (NLO) in QCD. Top-quark masses are fully taken into account throughout the calculation. The virtual two-loop amplitude has been generated using an extension of the program GoSam supplemented with an interface to Reduze for the integral reduction. The occurring integrals have been calculated numerically using the program SecDec. Our results, including the full top-quark mass dependence for the first time, allow us to assess the validity of various approximations proposed in the literature, which we also recalculate. We find substantial deviations between the NLO result and the different approximations, which emphasizes the importance of including the full top-quark mass dependence at NLO.

  10. Corrections beyond the leading order in π{sup 0} → e{sup +}e{sup −} process

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Husek, T.; Kampf, K.; Novotný, J.

    2016-01-22

    We briefly summarize experimental and theoretical results on the rare decay π{sup 0} → e{sup +}e{sup −}. Two-loop QED corrections are reviewed and the bremsstrahlung contribution beyond the soft-photon approximation is analytically calculated. Using the leading logarithm approximation, the possible contribution of QCD corrections is estimated. The complete result can be used to fit the value of the contact interaction coupling χ{sup (r)} to the recent KTeV experiment with the result χ{sup (r)}(M{sub ρ}) = 4.5±1.0.

  11. Large Electroweak Corrections to Vector-Boson Scattering at the Large Hadron Collider.

    PubMed

    Biedermann, Benedikt; Denner, Ansgar; Pellen, Mathieu

    2017-06-30

    For the first time full next-to-leading-order electroweak corrections to off-shell vector-boson scattering are presented. The computation features the complete matrix elements, including all nonresonant and off-shell contributions, to the electroweak process pp→μ^{+}ν_{μ}e^{+}ν_{e}jj and is fully differential. We find surprisingly large corrections, reaching -16% for the fiducial cross section, as an intrinsic feature of the vector-boson-scattering processes. We elucidate the origin of these large electroweak corrections upon using the double-pole approximation and the effective vector-boson approximation along with leading-logarithmic corrections.

  12. Travelling-wave solutions of a weakly nonlinear two-dimensional higher-order Kadomtsev-Petviashvili dynamical equation for dispersive shallow-water waves

    NASA Astrophysics Data System (ADS)

    Seadawy, Aly R.

    2017-01-01

    The propagation of three-dimensional nonlinear irrotational flow of an inviscid and incompressible fluid of the long waves in dispersive shallow-water approximation is analyzed. The problem formulation of the long waves in dispersive shallow-water approximation lead to fifth-order Kadomtsev-Petviashvili (KP) dynamical equation by applying the reductive perturbation theory. By using an extended auxiliary equation method, the solitary travelling-wave solutions of the two-dimensional nonlinear fifth-order KP dynamical equation are derived. An analytical as well as a numerical solution of the two-dimensional nonlinear KP equation are obtained and analyzed with the effects of external pressure flow.

  13. The effect of compressive viscosity and thermal conduction on the longitudinal MHD waves

    NASA Astrophysics Data System (ADS)

    Bahari, K.; Shahhosaini, N.

    2018-05-01

    longitudinal Magnetohydrodynamic (MHD) oscillations have been studied in a slowly cooling coronal loop, in the presence of thermal conduction and compressive viscosity, in the linear MHD approximation. WKB method has been used to solve the governing equations. In the leading order approximation the dispersion relation has been obtained, and using the first order approximation the time dependent amplitude has been determined. Cooling causes the oscillations to amplify and damping mechanisms are more efficient in hot loops. In cool loops the oscillation amplitude increases with time but in hot loops the oscillation amplitude decreases with time. Our conclusion is that in hot loops the efficiency of the compressive viscosity in damping longitudinal waves is comparable to that of the thermal conduction.

  14. Higher order corrections to mixed QCD-EW contributions to Higgs boson production in gluon fusion

    NASA Astrophysics Data System (ADS)

    Bonetti, Marco; Melnikov, Kirill; Tancredi, Lorenzo

    2018-03-01

    We present an estimate of the next-to-leading-order (NLO) QCD corrections to mixed QCD-electroweak contributions to the Higgs boson production cross section in gluon fusion, combining the recently computed three-loop virtual corrections and the approximate treatment of real emission in the soft approximation. We find that the NLO QCD corrections to the mixed QCD-electroweak contributions are nearly identical to NLO QCD corrections to QCD Higgs production. Our result confirms an earlier estimate of these O (α αs2) effects by Anastasiou et al. [J. High Energy Phys. 04 (2009) 003, 10.1088/1126-6708/2009/04/003] and provides further support for the factorization approximation of QCD and electroweak corrections.

  15. The effect of compressive viscosity and thermal conduction on the longitudinal MHD waves

    NASA Astrophysics Data System (ADS)

    Bahari, K.; Shahhosaini, N.

    2018-07-01

    Longitudinal magnetohydrodynamic (MHD) oscillations have been studied in a slowly cooling coronal loop, in the presence of thermal conduction and compressive viscosity, in the linear MHD approximation. The WKB method has been used to solve the governing equations. In the leading order approximation the dispersion relation has been obtained, and using the first-order approximation the time-dependent amplitude has been determined. Cooling causes the oscillations to amplify and damping mechanisms are more efficient in hot loops. In cool loops the oscillation amplitude increases with time but in hot loops the oscillation amplitude decreases with time. Our conclusion is that in hot loops the efficiency of the compressive viscosity in damping longitudinal waves is comparable to that of the thermal conduction.

  16. Cosmological Perturbation Theory and the Spherical Collapse model - I. Gaussian initial conditions

    NASA Astrophysics Data System (ADS)

    Fosalba, Pablo; Gaztanaga, Enrique

    1998-12-01

    We present a simple and intuitive approximation for solving the perturbation theory (PT) of small cosmic fluctuations. We consider only the spherically symmetric or monopole contribution to the PT integrals, which yields the exact result for tree-graphs (i.e. at leading order). We find that the non-linear evolution in Lagrangian space is then given by a simple local transformation over the initial conditions, although it is not local in Euler space. This transformation is found to be described by the spherical collapse (SC) dynamics, as it is the exact solution in the shearless (and therefore local) approximation in Lagrangian space. Taking advantage of this property, it is straightforward to derive the one-point cumulants, xi_J, for both the unsmoothed and smoothed density fields to arbitrary order in the perturbative regime. To leading-order this reproduces, and provides us with a simple explanation for, the exact results obtained by Bernardeau. We then show that the SC model leads to accurate estimates for the next corrective terms when compared with the results derived in the exact perturbation theory making use of the loop calculations. The agreement is within a few per cent for the hierarchical ratios S_J=xi_J/xi^J-1_2. We compare our analytic results with N-body simulations, which turn out to be in very good agreement up to scales where sigma~1. A similar treatment is presented to estimate higher order corrections in the Zel'dovich approximation. These results represent a powerful and readily usable tool to produce analytical predictions that describe the gravitational clustering of large-scale structure in the weakly non-linear regime.

  17. Order reduction for a model of marine bacteriophage evolution

    NASA Astrophysics Data System (ADS)

    Pagliarini, Silvia; Korobeinikov, Andrei

    2017-02-01

    A typical mechanistic model of viral evolution necessary includes several time scales which can differ by orders of magnitude. Such a diversity of time scales makes analysis of these models difficult. Reducing the order of a model is highly desirable when handling such a model. A typical approach applied to such slow-fast (or singularly perturbed) systems is the time scales separation technique. Constructing the so-called quasi-steady-state approximation is the usual first step in applying the technique. While this technique is commonly applied, in some cases its straightforward application can lead to unsatisfactory results. In this paper we construct the quasi-steady-state approximation for a model of evolution of marine bacteriophages based on the Beretta-Kuang model. We show that for this particular model the quasi-steady-state approximation is able to produce only qualitative but not quantitative fit.

  18. Stochastic Optimal Prediction with Application to Averaged Euler Equations

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Bell, John; Chorin, Alexandre J.; Crutchfield, William

    Optimal prediction (OP) methods compensate for a lack of resolution in the numerical solution of complex problems through the use of an invariant measure as a prior measure in the Bayesian sense. In first-order OP, unresolved information is approximated by its conditional expectation with respect to the invariant measure. In higher-order OP, unresolved information is approximated by a stochastic estimator, leading to a system of random or stochastic differential equations. We explain the ideas through a simple example, and then apply them to the solution of Averaged Euler equations in two space dimensions.

  19. Chemical association in simple models of molecular and ionic fluids. III. The cavity function

    NASA Astrophysics Data System (ADS)

    Zhou, Yaoqi; Stell, George

    1992-01-01

    Exact equations which relate the cavity function to excess solvation free energies and equilibrium association constants are rederived by using a thermodynamic cycle. A zeroth-order approximation, derived previously by us as a simple interpolation scheme, is found to be very accurate if the associative bonding occurs on or near the surface of the repulsive core of the interaction potential. If the bonding radius is substantially less than the core radius, the approximation overestimates the association degree and the association constant. For binary association, the zeroth-order approximation is equivalent to the first-order thermodynamic perturbation theory (TPT) of Wertheim. For n-particle association, the combination of the zeroth-order approximation with a ``linear'' approximation (for n-particle distribution functions in terms of the two-particle function) yields the first-order TPT result. Using our exact equations to go beyond TPT, near-exact analytic results for binary hard-sphere association are obtained. Solvent effects on binary hard-sphere association and ionic association are also investigated. A new rule which generalizes Le Chatelier's principle is used to describe the three distinct forms of behaviors involving solvent effects that we find. The replacement of the dielectric-continuum solvent model by a dipolar hard-sphere model leads to improved agreement with an experimental observation. Finally, equation of state for an n-particle flexible linear-chain fluid is derived on the basis of a one-parameter approximation that interpolates between the generalized Kirkwood superposition approximation and the linear approximation. A value of the parameter that appears to be near optimal in the context of this application is obtained from comparison with computer-simulation data.

  20. APPROXIMATING SYMMETRIC POSITIVE SEMIDEFINITE TENSORS OF EVEN ORDER*

    PubMed Central

    BARMPOUTIS, ANGELOS; JEFFREY, HO; VEMURI, BABA C.

    2012-01-01

    Tensors of various orders can be used for modeling physical quantities such as strain and diffusion as well as curvature and other quantities of geometric origin. Depending on the physical properties of the modeled quantity, the estimated tensors are often required to satisfy the positivity constraint, which can be satisfied only with tensors of even order. Although the space P02m of 2mth-order symmetric positive semi-definite tensors is known to be a convex cone, enforcing positivity constraint directly on P02m is usually not straightforward computationally because there is no known analytic description of P02m for m > 1. In this paper, we propose a novel approach for enforcing the positivity constraint on even-order tensors by approximating the cone P02m for the cases 0 < m < 3, and presenting an explicit characterization of the approximation Σ2m ⊂ Ω2m for m ≥ 1, using the subset Ω2m⊂P02m of semi-definite tensors that can be written as a sum of squares of tensors of order m. Furthermore, we show that this approximation leads to a non-negative linear least-squares (NNLS) optimization problem with the complexity that equals the number of generators in Σ2m. Finally, we experimentally validate the proposed approach and we present an application for computing 2mth-order diffusion tensors from Diffusion Weighted Magnetic Resonance Images. PMID:23285313

  1. Resummed Differential Cross Sections for Top-Quark Pairs at the LHC.

    PubMed

    Pecjak, Benjamin D; Scott, Darren J; Wang, Xing; Yang, Li Lin

    2016-05-20

    We present state of the art resummation predictions for differential cross sections in top-quark pair production at the LHC. They are derived from a formalism which allows the simultaneous resummation of both soft and small-mass logarithms, which endanger the convergence of fixed-order perturbative series in the boosted regime, where the partonic center-of-mass energy is much larger than the mass to the top quark. We combine such a double resummation at next-to-next-to-leading logarithmic^{'} (NNLL^{'}) accuracy with standard soft-gluon resummation at next-to-next-to-leading logarithmic accuracy and with next-to-leading-order calculations, so that our results are applicable throughout the whole phase space. We find that the resummation effects on the differential distributions are significant, bringing theoretical predictions into better agreement with experimental data compared to fixed-order calculations. Moreover, such effects are not well described by the next-to-next-to-leading-order approximation of the resummation formula, especially in the high-energy tails of the distributions, highlighting the importance of all-orders resummation in dedicated studies of boosted top production.

  2. Approximate method for calculating transonic flow about lifting wing-body configurations: Computer program and user's manual

    NASA Technical Reports Server (NTRS)

    Barnwell, R. W.; Davis, R. M.

    1975-01-01

    A user's manual is presented for a computer program which calculates inviscid flow about lifting configurations in the free-stream Mach-number range from zero to low supersonic. Angles of attack of the order of the configuration thickness-length ratio and less can be calculated. An approximate formulation was used which accounts for shock waves, leading-edge separation and wind-tunnel wall effects.

  3. First-Order System Least-Squares for Second-Order Elliptic Problems with Discontinuous Coefficients

    NASA Technical Reports Server (NTRS)

    Manteuffel, Thomas A.; McCormick, Stephen F.; Starke, Gerhard

    1996-01-01

    The first-order system least-squares methodology represents an alternative to standard mixed finite element methods. Among its advantages is the fact that the finite element spaces approximating the pressure and flux variables are not restricted by the inf-sup condition and that the least-squares functional itself serves as an appropriate error measure. This paper studies the first-order system least-squares approach for scalar second-order elliptic boundary value problems with discontinuous coefficients. Ellipticity of an appropriately scaled least-squares bilinear form of the size of the jumps in the coefficients leading to adequate finite element approximation results. The occurrence of singularities at interface corners and cross-points is discussed. and a weighted least-squares functional is introduced to handle such cases. Numerical experiments are presented for two test problems to illustrate the performance of this approach.

  4. Compatible diagonal-norm staggered and upwind SBP operators

    NASA Astrophysics Data System (ADS)

    Mattsson, Ken; O'Reilly, Ossian

    2018-01-01

    The main motivation with the present study is to achieve a provably stable high-order accurate finite difference discretisation of linear first-order hyperbolic problems on a staggered grid. The use of a staggered grid makes it non-trivial to discretise advective terms. To overcome this difficulty we discretise the advective terms using upwind Summation-By-Parts (SBP) operators, while the remaining terms are discretised using staggered SBP operators. The upwind and staggered SBP operators (for each order of accuracy) are compatible, here meaning that they are based on the same diagonal norms, allowing for energy estimates to be formulated. The boundary conditions are imposed using a penalty (SAT) technique, to guarantee linear stability. The resulting SBP-SAT approximations lead to fully explicit ODE systems. The accuracy and stability properties are demonstrated for linear hyperbolic problems in 1D, and for the 2D linearised Euler equations with constant background flow. The newly derived upwind and staggered SBP operators lead to significantly more accurate numerical approximations, compared with the exclusive usage of (previously derived) central-difference first derivative SBP operators.

  5. NLO evolution of color dipole

    DOE PAGES

    Balitsky, Ian; Chirilli, Giovanni A.

    2008-09-01

    The small-x deep inelastic scattering in the saturation region is governed by the non-linear evolution of Wilson-line operators. In the leading logarithmic approximation it is given by the BK equation for the evolution of color dipoles. In the next-to-leading order the BK equation gets contributions from quark and gluon loops as well as from the tree gluon diagrams with quadratic and cubic nonlinearities.

  6. An approximation method for configuration optimization of trusses

    NASA Technical Reports Server (NTRS)

    Hansen, Scott R.; Vanderplaats, Garret N.

    1988-01-01

    Two- and three-dimensional elastic trusses are designed for minimum weight by varying the areas of the members and the location of the joints. Constraints on member stresses and Euler buckling are imposed and multiple static loading conditions are considered. The method presented here utilizes an approximate structural analysis based on first order Taylor series expansions of the member forces. A numerical optimizer minimizes the weight of the truss using information from the approximate structural analysis. Comparisons with results from other methods are made. It is shown that the method of forming an approximate structural analysis based on linearized member forces leads to a highly efficient method of truss configuration optimization.

  7. Solar neutrino masses and mixing from bilinear R-parity broken supersymmetry: Analytical versus numerical results

    NASA Astrophysics Data System (ADS)

    Díaz, M.; Hirsch, M.; Porod, W.; Romão, J.; Valle, J.

    2003-07-01

    We give an analytical calculation of solar neutrino masses and mixing at one-loop order within bilinear R-parity breaking supersymmetry, and compare our results to the exact numerical calculation. Our method is based on a systematic perturbative expansion of R-parity violating vertices to leading order. We find in general quite good agreement between the approximate and full numerical calculations, but the approximate expressions are much simpler to implement. Our formalism works especially well for the case of the large mixing angle Mikheyev-Smirnov-Wolfenstein solution, now strongly favored by the recent KamLAND reactor neutrino data.

  8. Higgs radiation off top quarks at the Tevatron and the LHC.

    PubMed

    Beenakker, W; Dittmaier, S; Krämer, M; Plümper, B; Spira, M; Zerwas, P M

    2001-11-12

    Higgs bosons can be searched for in the channels pp macro/pp-->tt macro H + X at the Fermilab Tevatron and the Cern Large Hadron Collider (LHC). We have calculated the QCD corrections to these processes in the standard model at next-to-leading order. The higher-order corrections reduce the renormalization and factorization scale dependence considerably and stabilize the theoretical predictions for the cross sections. At the central scale mu = (2m(t)+M(H))/2 the properly defined K factors are slightly below unity for the Tevatron (K approximately 0.8) and slightly above unity for the LHC (K approximately 1.2).

  9. Asymptotic form for the cross section for the Coulomb interacting rearrangement collisions

    NASA Technical Reports Server (NTRS)

    Omidvar, K.

    1973-01-01

    It is shown that in a rearrangement collision leading to the formation of the highly excited hydrogenlike states the cross section in all orders of the Born approximation behaves as 1/n sq, with n the principal quantum number, thus invalidating the Brinkman-Kramers approximation for large n. Similarly, in high energy inelastic electron-hydrogenlike atom collisions the exchange cross section for sufficiently large n dominates the direct excitation cross section.

  10. Synaptic shot noise and conductance fluctuations affect the membrane voltage with equal significance.

    PubMed

    Richardson, Magnus J E; Gerstner, Wulfram

    2005-04-01

    The subthreshold membrane voltage of a neuron in active cortical tissue is a fluctuating quantity with a distribution that reflects the firing statistics of the presynaptic population. It was recently found that conductance-based synaptic drive can lead to distributions with a significant skew. Here it is demonstrated that the underlying shot noise caused by Poissonian spike arrival also skews the membrane distribution, but in the opposite sense. Using a perturbative method, we analyze the effects of shot noise on the distribution of synaptic conductances and calculate the consequent voltage distribution. To first order in the perturbation theory, the voltage distribution is a gaussian modulated by a prefactor that captures the skew. The gaussian component is identical to distributions derived using current-based models with an effective membrane time constant. The well-known effective-time-constant approximation can therefore be identified as the leading-order solution to the full conductance-based model. The higher-order modulatory prefactor containing the skew comprises terms due to both shot noise and conductance fluctuations. The diffusion approximation misses these shot-noise effects implying that analytical approaches such as the Fokker-Planck equation or simulation with filtered white noise cannot be used to improve on the gaussian approximation. It is further demonstrated that quantities used for fitting theory to experiment, such as the voltage mean and variance, are robust against these non-Gaussian effects. The effective-time-constant approximation is therefore relevant to experiment and provides a simple analytic base on which other pertinent biological details may be added.

  11. Momentum-space cluster dual-fermion method

    NASA Astrophysics Data System (ADS)

    Iskakov, Sergei; Terletska, Hanna; Gull, Emanuel

    2018-03-01

    Recent years have seen the development of two types of nonlocal extensions to the single-site dynamical mean field theory. On one hand, cluster approximations, such as the dynamical cluster approximation, recover short-range momentum-dependent correlations nonperturbatively. On the other hand, diagrammatic extensions, such as the dual-fermion theory, recover long-ranged corrections perturbatively. The correct treatment of both strong short-ranged and weak long-ranged correlations within the same framework is therefore expected to lead to a quick convergence of results, and offers the potential of obtaining smooth self-energies in nonperturbative regimes of phase space. In this paper, we present an exact cluster dual-fermion method based on an expansion around the dynamical cluster approximation. Unlike previous formulations, our method does not employ a coarse-graining approximation to the interaction, which we show to be the leading source of error at high temperature, and converges to the exact result independently of the size of the underlying cluster. We illustrate the power of the method with results for the second-order cluster dual-fermion approximation to the single-particle self-energies and double occupancies.

  12. Pressure-Induced Phase Transitions in the Cd-Yb Periodic Approximant to a Quasicrystal

    NASA Astrophysics Data System (ADS)

    Watanuki, Tetsu; Machida, Akihiko; Ikeda, Tomohiro; Aoki, Katsutoshi; Kaneko, Hiroshi; Shobu, Takahisa; Sato, Taku J.; Tsai, An Pang

    2006-03-01

    The phase study of a Cd-Yb 1/1 approximant crystal over a wide pressure and temperature range is crucial for the comparison study between periodic and quasiperiodic crystals. The Cd4 tetrahedra, the most inner part of the atomic clusters, exhibited various structural ordering in the orientation sensitive to pressure and temperature. Five ordered phases appeared in a P-T span up to 5.2 GPa and down to 10 K. The propagation direction of ordering alternated from [110] to ⟨111⟩ at about 1.0 GPa and again to [110] at 3.5 4.3 GPa. The primarily ordered phases that appeared by cooling to 210 250 K between 1.0 5.2 GPa further transformed to finely ordered ones at 120 155 K. Besides the original short-range type interaction, a long-range type interaction was likely developed under pressure to lead to the primary ordering of Cd4 tetrahedra. Coexistence of these interactions is responsible for the complicated phase behavior.

  13. Spin polarized photons from an axially charged plasma at weak coupling: Complete leading order

    DOE PAGES

    Mamo, Kiminad A.; Yee, Ho-Ung

    2016-03-24

    In the presence of (approximately conserved) axial charge in the QCD plasma at finite temperature, the emitted photons are spin aligned, which is a unique P- and CP-odd signature of axial charge in the photon emission observables. We compute this “P-odd photon emission rate” in a weak coupling regime at a high temperature limit to complete leading order in the QCD coupling constant: the leading log as well as the constant under the log. As in the P-even total emission rate in the literature, the computation of the P-odd emission rate at leading order consists of three parts: (1) Comptonmore » and pair annihilation processes with hard momentum exchange, (2) soft t- and u-channel contributions with hard thermal loop resummation, (3) Landau-Pomeranchuk-Migdal resummation of collinear bremsstrahlung and pair annihilation. In conclusion, we present analytical and numerical evaluations of these contributions to our P-odd photon emission rate observable.« less

  14. Next-to-leading-order QCD corrections to Higgs boson production in association with a top quark pair and a jet.

    PubMed

    van Deurzen, H; Luisoni, G; Mastrolia, P; Mirabella, E; Ossola, G; Peraro, T

    2013-10-25

    We present the calculation of the cross section for Higgs boson production in association with a top quark pair plus one jet, at next-to-leading-order accuracy in QCD. All mass dependence is retained without recurring to any approximation. After including the complete next-to-leading-order QCD corrections, we observe a strong reduction in the scale dependence of the result. We also show distributions for the invariant mass of the top quark pair, with and without the additional jet, and for the transverse momentum and the pseudorapidity of the Higgs boson. Results for the virtual contributions are obtained with a novel reduction approach based on integrand decomposition via the Laurent expansion, as implemented in the library, NINJA. Cross sections and differential distributions are obtained with an automated setup which combines the GOSAM and SHERPA frameworks.

  15. B B ¯ angular correlations at the LHC in the parton Reggeization approach merged with higher-order matrix elements

    NASA Astrophysics Data System (ADS)

    Karpishkov, A. V.; Nefedov, M. A.; Saleev, V. A.

    2017-11-01

    We calculate the angular distribution spectra between beauty (B ) and antibeauty (B ¯) mesons in proton-proton collisions in the leading order approximation of the parton Reggeization approach consistently merged with the next-to-leading order corrections from the emission of an additional hard gluon. To describe b-quark hadronization we use the universal scale-dependent parton-to-meson fragmentation functions extracted from the world e+e- annihilation data. We have obtained good agreement between our predictions and data from the CMS Collaboration at the energy √{S }=7 TeV for B B ¯ angular correlations within uncertainties and without free parameters. Predictions for analogous correlation observables at √{S }=13 TeV are provided.

  16. Constraining modified theories of gravity with the galaxy bispectrum

    NASA Astrophysics Data System (ADS)

    Yamauchi, Daisuke; Yokoyama, Shuichiro; Tashiro, Hiroyuki

    2017-12-01

    We explore the use of the galaxy bispectrum induced by the nonlinear gravitational evolution as a possible probe to test general scalar-tensor theories with second-order equations of motion. We find that time dependence of the leading second-order kernel is approximately characterized by one parameter, the second-order index, which is expected to trace the higher-order growth history of the Universe. We show that our new parameter can significantly carry new information about the nonlinear growth of structure. We forecast future constraints on the second-order index as well as the equation-of-state parameter and the growth index.

  17. Extension of the self-consistent-charge density-functional tight-binding method: third-order expansion of the density functional theory total energy and introduction of a modified effective coulomb interaction.

    PubMed

    Yang, Yang; Yu, Haibo; York, Darrin; Cui, Qiang; Elstner, Marcus

    2007-10-25

    The standard self-consistent-charge density-functional-tight-binding (SCC-DFTB) method (Phys. Rev. B 1998, 58, 7260) is derived by a second-order expansion of the density functional theory total energy expression, followed by an approximation of the charge density fluctuations by charge monopoles and an effective damped Coulomb interaction between the atomic net charges. The central assumptions behind this effective charge-charge interaction are the inverse relation of atomic size and chemical hardness and the use of a fixed chemical hardness parameter independent of the atomic charge state. While these approximations seem to be unproblematic for many covalently bound systems, they are quantitatively insufficient for hydrogen-bonding interactions and (anionic) molecules with localized net charges. Here, we present an extension of the SCC-DFTB method to incorporate third-order terms in the charge density fluctuations, leading to chemical hardness parameters that are dependent on the atomic charge state and a modification of the Coulomb scaling to improve the electrostatic treatment within the second-order terms. These modifications lead to a significant improvement in the description of hydrogen-bonding interactions and proton affinities of biologically relevant molecules.

  18. Creeping gaseous flows through elastic tube and annulus micro-configurations

    NASA Astrophysics Data System (ADS)

    Elbaz, Shai; Jacob, Hila; Gat, Amir

    2016-11-01

    Gaseous flows in elastic micro-configurations is relevant to biological systems (e.g. alveolar ducts in the lungs) as well as to applications such as gas actuated soft micro-robots. We here examine the effect of low-Mach-number compressibility on creeping gaseous axial flows through linearly elastic tube and annulus micro-configurations. For steady flows, the leading-order effects of elasticity on the pressure distribution and mass-flux are obtained. For transient flow in a tube with small deformations, elastic effects are shown to be negligible in leading order due to compressibility. We then examine transient flows in annular configurations where the deformation is significant compared with the gap between the inner and outer cylinders defining the annulus. Both compressibility and elasticity are obtained as dominant terms interacting with viscosity. For a sudden flux impulse, the governing non-linear leading order diffusion equation is initially approximated by a porous-medium-equation of order 2.5 for the pressure square. However, as the fluid expand and the pressure decreases, the governing equation degenerates to a porous-medium-equation of order 2 for the pressure.

  19. A fast Cauchy-Riemann solver. [differential equation solution for boundary conditions by finite difference approximation

    NASA Technical Reports Server (NTRS)

    Ghil, M.; Balgovind, R.

    1979-01-01

    The inhomogeneous Cauchy-Riemann equations in a rectangle are discretized by a finite difference approximation. Several different boundary conditions are treated explicitly, leading to algorithms which have overall second-order accuracy. All boundary conditions with either u or v prescribed along a side of the rectangle can be treated by similar methods. The algorithms presented here have nearly minimal time and storage requirements and seem suitable for development into a general-purpose direct Cauchy-Riemann solver for arbitrary boundary conditions.

  20. Wrinkling of a thin circular sheet bonded to a spherical substrate

    PubMed Central

    Kohn, Robert V.

    2017-01-01

    We consider a disc-shaped thin elastic sheet bonded to a compliant sphere. (Our sheet can slip along the sphere; the bonding controls only its normal displacement.) If the bonding is stiff (but not too stiff), the geometry of the sphere makes the sheet wrinkle to avoid azimuthal compression. The total energy of this system is the elastic energy of the sheet plus a (Winkler-type) substrate energy. Treating the thickness of the sheet h as a small parameter, we determine the leading-order behaviour of the energy as h tends to zero, and we give (almost matching) upper and lower bounds for the next-order correction. Our analysis of the leading-order behaviour determines the macroscopic deformation of the sheet; in particular, it determines the extent of the wrinkled region, and predicts the (non-trivial) radial strain of the sheet. The leading-order behaviour also provides insight about the length scale of the wrinkling, showing that it must be approximately independent of the distance r from the centre of the sheet (so that the number of wrinkles must increase with r). Our results on the next-order correction provide insight about how the wrinkling pattern should vary with r. Roughly speaking, they suggest that the length scale of wrinkling should not be exactly constant—rather, it should vary slightly, so that the number of wrinkles at radius r can be approximately piecewise constant in its dependence on r, taking values that are integer multiples of h−a with . This article is part of the themed issue ‘Patterning through instabilities in complex media: theory and applications’. PMID:28373380

  1. Cosmic microwave background bispectrum from primordial magnetic fields on large angular scales.

    PubMed

    Seshadri, T R; Subramanian, Kandaswamy

    2009-08-21

    Primordial magnetic fields lead to non-Gaussian signals in the cosmic microwave background (CMB) even at the lowest order, as magnetic stresses and the temperature anisotropy they induce depend quadratically on the magnetic field. In contrast, CMB non-Gaussianity due to inflationary scalar perturbations arises only as a higher-order effect. We propose a novel probe of stochastic primordial magnetic fields that exploits the characteristic CMB non-Gaussianity that they induce. We compute the CMB bispectrum (b(l1l2l3)) induced by such fields on large angular scales. We find a typical value of l1(l1 + 1)l3(l3 + 1)b(l1l2l3) approximately 10(-22), for magnetic fields of strength B0 approximately 3 nG and with a nearly scale invariant magnetic spectrum. Observational limits on the bispectrum allow us to set upper limits on B0 approximately 35 nG.

  2. Nonequilibrium self-energies, Ng approach, and heat current of a nanodevice for small bias voltage and temperature

    NASA Astrophysics Data System (ADS)

    Aligia, A. A.

    2014-03-01

    Using nonequilibrium renormalized perturbation theory to second order in the renormalized Coulomb repulsion, we calculate the lesser Σ< and and greater Σ> self-energies of the impurity Anderson model, which describes the current through a quantum dot, in the general asymmetric case. While in general a numerical integration is required to evaluate the perturbative result, we derive an analytical approximation for small frequency ω, bias voltage V, and temperature T, which is exact to total second order in these quantities. The approximation is valid when the corresponding energies ℏω, eV, and kBT are small compared to kBTK, where TK is the Kondo temperature. The result of the numerical integration is compared with the analytical one and with Ng approximation, in which Σ< and Σ> are assumed proportional to the retarded self-energy Σr times an average Fermi function. While it fails at T =0 for ℏ |ω|≲eV, we find that the Ng approximation is excellent for kBT>eV/2 and improves for asymmetric coupling to the leads. Even at T =0, the effect of the Ng approximation on the total occupation at the dot is very small. The dependence on ω and V are discussed in comparison with a Ward identity that is fulfilled by the three approaches. We also calculate the heat currents between the dot and any of the leads at finite bias voltage. One of the heat currents changes sign with the applied bias voltage at finite temperature.

  3. SU-F-T-686: Considerations About Dose Protraction Factor in TCP Calculations for Prostate VMAT Treatments

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Clemente, F; Perez-Vara, C; Clavo, M

    2016-06-15

    Purpose: Dose protraction factor should be considered in order to model the TCP calculations. Nevertheless, this study describes a brief discussion showing that the lack of its inclusion should not invalidate these calculations for prostate VMAT treatments. Methods: Dose protraction factor (G) modifies the quadratic term of the linear-quadratic expression in order to take into account the sublethal damage repair of protracting the dose delivery. If the delivery takes a short time (instantaneous), G = 1. For any other dose delivery pattern, G < 1. The Lea-Catcheside dose protraction factor for external beam radiotherapy contains terms depending of on themore » tissue specific repair parameter (λ) and the irradiation time (T). Expanding the exponential term using a Taylor’s series and neglecting terms of order (λT){sup 3}, the approximation leads to G = 1. The described situation occurs for 3DCRT techniques, where treatment times are about few minutes. For IMRT techniques, fraction times are prolonged compared to 3DCRT times. Wang et al. (2003) and Fowler et al. (2004) investigated the protraction effect with respect to IMRT treatments, reporting clinically significant loss in biological effect associated with IMRT delivery times. Results: Treatment times are noticeably reduced for prostate treatments using VMAT techniques. These times are comparable to 3DCRT times, leading to consider the previous approximation. Conclusion: Dose protraction factor can be approximated by G = 1 in TCP calculations for prostate treatments using VMAT techniques.« less

  4. Study of weak corrections to Drell-Yan, top-quark pair, and dijet production at high energies with MCFM

    DOE PAGES

    Campbell, John M.; Wackeroth, Doreen; Zhou, Jia

    2016-11-29

    Electroweak (EW) corrections can be enhanced at high energies due to the soft or collinear radiation of virtual and real W and Z bosons that result in Sudakov-like corrections of the form αmore » $$l\\atop{W}$$log n(Q 2/M2$$\\atop{W,Z}$$), where α W=α/(4π sin 2θ W) and n ≤ 2l-1. The inclusion of EW corrections in predictions for hadron colliders is, therefore, especially important when searching for signals of possible new physics in distributions probing the kinematic regime Q 2>>M$$2\\atop{V}$$. Next-to-leading order (NLO) EW corrections should also be taken into account when their size [O(α)] is comparable to that of QCD corrections at next-to-next-to-leading order (NNLO) [O(α$$2\\atop{s}$$)]. To this end, we have implemented the NLO weak corrections to the neutral-current Drell-Yan process, top-quark pair production and dijet production in the parton-level Monte Carlo program MCFM. This enables a combined study with the corresponding QCD corrections at NLO and NNLO. We provide both the full NLO weak corrections and their Sudakov approximation since the latter is often used for a fast evaluation of weak effects at high energies and can be extended to higher orders. Finally, with both the exact and approximate results at hand, the validity of the Sudakov approximation can be readily quantified.« less

  5. Top-quark loop corrections in Z+jet and Z + 2 jet production

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Campbell, John M.; Keith Ellis, R.

    2017-01-01

    The sophistication of current predictions formore » $Z+$jet production at hadron colliders necessitates a re-evaluation of any approximations inherent in the theoretical calculations. In this paper we address one such issue, the inclusion of mass effects in top-quark loops. We ameliorate an existing calculation of $Z+1$~jet and $Z+2$~jet production by presenting exact analytic formulae for amplitudes containing top-quark loops that enter at next-to-leading order in QCD. Although approximations based on an expansion in powers of $$1/m_t^2$$ can lead to poor high-energy behavior, an exact treatment of top-quark loops demonstrates that their effect is small and has limited phenomenological interest.« less

  6. Effects of Alternate Leading Edge Cutback on the Space Shuttle Main Engine Low Pressure Fuel Pump

    NASA Technical Reports Server (NTRS)

    Mulder, Andrew; Skelley, Stephen

    2016-01-01

    A higher order cavitation oscillation observed in the SSME low pressure fuel pump has been eliminated in water flow testing of a modified subscale replica of the inducer. The low pressure pump was modified by removing the outboard sections of two opposing blades of the four-bladed inducer, blending the "cutback" regions into the blades at the leading edge and tip, and removing material on the suction sides to decrease the exposed leading edge thickness. The leading edge tips of the cutback blades were moved approximately 25 degrees from their previous locations, thereby increasing one blade to blade spacing, decreasing the second, while simultaneously moving the cutback tips downstream. The test was conducted in MSFC's inducer test loop at scaled operating conditions in degassed and filtered water. In addition to eliminating HOC across the entire scaled operating regime, rotating cavitation was suppressed while the range of both alternate blade and asymmetric cavitation were increased. These latter phenomena, and more significantly, the shifts between these cavitation modes also resulted in significant changes to the head coefficient at low cavitation numbers. Reverse flow was detected at a slightly larger flow coefficient with the cutback inducer and suction capability was reduced by approximately 1 velocity head at and above approximately 90% of the reference flow coefficient. These performance changes along with more intense reverse flow are consistent with poor flow area management and increased incidence in the cutback region. Although the test demonstrated that the inducer modification was successful at eliminating the higher order cavitation across the entire scaled operating regime, different, previously unobserved, cavitation oscillations were introduced and significant performance penalties were imposed.

  7. Diphoton production in association with two bottom jets

    NASA Astrophysics Data System (ADS)

    Fäh, Daniel; Greiner, Nicolas

    2017-11-01

    We study the production of a photon pair in association with two bottom jets at the LHC. This process constitutes an important background to double Higgs production with the subsequent decay of the two Higgs bosons into a pair of photons and b-quarks respectively. We calculate this process at next-to-leading order accuracy in QCD and find that QCD corrections lead to a substantial increase of the production cross section due to new channels opening up at next-to-leading order and their inclusion is therefore inevitable for a reliable prediction. Furthermore, the approximation of massless b-quarks is scrutinized by calculating the process with both massless and massive b-quarks. We find that the massive bottom quark leads to a substantial reduction of the cross section where the biggest effect is, however, due to the use of a four-flavor PDF set and the corresponding smaller values for the strong coupling constant.

  8. Driving missing data at next-to-leading order

    NASA Astrophysics Data System (ADS)

    Bern, Z.; Diana, G.; Dixon, L. J.; Febres Cordero, F.; Höche, S.; Ita, H.; Kosower, D. A.; Maître, D.; Ozeren, K. J.

    2011-12-01

    The prediction of backgrounds to new-physics signals in topologies with large missing transverse energy and jets is important to new-physics searches at the LHC. Following a CMS study, we investigate theoretical issues in using measurements of γ+2-jet production to predict the irreducible background to searches for missing energy plus two jets that originates from Z+2-jet production where the Z boson decays to neutrinos. We compute ratios of γ+2-jet to Z+2-jet production cross sections and kinematic distributions at next-to-leading order in αs, as well as using a parton shower matched to leading-order matrix elements. The former ratios rely on the first next-to-leading-order calculation of γ+2-jet production at a hadron collider. We find that the ratios obtained in the two approximations are quite similar, making γ+2-jet production a theoretically reliable estimator for the missing energy plus two jets background. We employ a Frixione-style photon isolation, but we also show that for isolated prompt-photon production at high transverse momentum the difference between this criterion and the standard-cone isolation used by CMS is small.

  9. Alternative Analysis of the Michaelis-Menten Equations

    ERIC Educational Resources Information Center

    Krogstad, Harald E.; Dawed, Mohammed Yiha; Tegegne, Tadele Tesfa

    2011-01-01

    Courses in mathematical modelling are always in need of simple, illustrative examples. The Michaelis-Menten reaction kinetics equations have been considered to be a basic example of scaling and singular perturbation. However, the leading order approximations do not easily show the expected behaviour, and this note proposes a different perturbation…

  10. Semi-classical analysis and pseudo-spectra

    NASA Astrophysics Data System (ADS)

    Davies, E. B.

    We prove an approximate spectral theorem for non-self-adjoint operators and investigate its applications to second-order differential operators in the semi-classical limit. This leads to the construction of a twisted FBI transform. We also investigate the connections between pseudo-spectra and boundary conditions in the semi-classical limit.

  11. Frequency and time-domain inspiral templates for comparable mass compact binaries in eccentric orbits

    NASA Astrophysics Data System (ADS)

    Tanay, Sashwat; Haney, Maria; Gopakumar, Achamveedu

    2016-03-01

    Inspiraling compact binaries with non-negligible orbital eccentricities are plausible gravitational wave (GW) sources for the upcoming network of GW observatories. In this paper, we present two prescriptions to compute post-Newtonian (PN) accurate inspiral templates for such binaries. First, we adapt and extend the postcircular scheme of Yunes et al. [Phys. Rev. D 80, 084001 (2009)] to obtain a Fourier-domain inspiral approximant that incorporates the effects of PN-accurate orbital eccentricity evolution. This results in a fully analytic frequency-domain inspiral waveform with Newtonian amplitude and 2PN-order Fourier phase while incorporating eccentricity effects up to sixth order at each PN order. The importance of incorporating eccentricity evolution contributions to the Fourier phase in a PN-consistent manner is also demonstrated. Second, we present an accurate and efficient prescription to incorporate orbital eccentricity into the quasicircular time-domain TaylorT4 approximant at 2PN order. New features include the use of rational functions in orbital eccentricity to implement the 1.5PN-order tail contributions to the far-zone fluxes. This leads to closed form PN-accurate differential equations for evolving eccentric orbits, and the resulting time-domain approximant is accurate and efficient to handle initial orbital eccentricities ≤0.9 . Preliminary GW data analysis implications are probed using match estimates.

  12. Noniterative estimation of a nonlinear parameter

    NASA Technical Reports Server (NTRS)

    Bergstroem, A.

    1973-01-01

    An algorithm is described which solves the parameters X = (x1,x2,...,xm) and p in an approximation problem Ax nearly equal to y(p), where the parameter p occurs nonlinearly in y. Instead of linearization methods, which require an approximate value of p to be supplied as a priori information, and which may lead to the finding of local minima, the proposed algorithm finds the global minimum by permitting the use of series expansions of arbitrary order, exploiting an a priori knowledge that the addition of a particular function, corresponding to a new column in A, will not improve the goodness of the approximation.

  13. Transport theory and the WKB approximation for interplanetary MHD fluctuations

    NASA Technical Reports Server (NTRS)

    Matthaeus, William H.; Zhou, YE; Zank, G. P.; Oughton, S.

    1994-01-01

    An alternative approach, based on a multiple scale analysis, is presented in order to reconcile the traditional Wentzel-Kramer-Brillouin (WKB) approach to the modeling of interplanetary fluctuations in a mildly inhomogeneous large-scale flow with a more recently developed transport theory. This enables us to compare directly, at a formal level, the inherent structure of the two models. In the case of noninteracting, incompressible (Alven) waves, the principle difference between the two models is the presence of leading-order couplings (called 'mixing effects') in the non-WKB turbulence model which are absent in a WKB development. Within the context of linearized MHD, two cases have been identified for which the leading order non-WJB 'mixing term' does not vanish at zero wavelength. For these cases the WKB expansion is divergent, whereas the multiple-scale theory is well behaved. We have thus established that the WKB results are contained within the multiple-scale theory, but leading order mixing effects, which are likely to have important observational consequences, can never be recovered in the WKB style expansion. Properties of the higher-order terms in each expansion are also discussed, leading to the conclusion that the non-WKB hierarchy may be applicable even when the scale separation parameter is not small.

  14. A gauge-independent zeroth-order regular approximation to the exact relativistic Hamiltonian—Formulation and applications

    NASA Astrophysics Data System (ADS)

    Filatov, Michael; Cremer, Dieter

    2005-01-01

    A simple modification of the zeroth-order regular approximation (ZORA) in relativistic theory is suggested to suppress its erroneous gauge dependence to a high level of approximation. The method, coined gauge-independent ZORA (ZORA-GI), can be easily installed in any existing nonrelativistic quantum chemical package by programming simple one-electron matrix elements for the quasirelativistic Hamiltonian. Results of benchmark calculations obtained with ZORA-GI at the Hartree-Fock (HF) and second-order Møller-Plesset perturbation theory (MP2) level for dihalogens X2 (X=F,Cl,Br,I,At) are in good agreement with the results of four-component relativistic calculations (HF level) and experimental data (MP2 level). ZORA-GI calculations based on MP2 or coupled-cluster theory with single and double perturbations and a perturbative inclusion of triple excitations [CCSD(T)] lead to accurate atomization energies and molecular geometries for the tetroxides of group VIII elements. With ZORA-GI/CCSD(T), an improved estimate for the atomization energy of hassium (Z=108) tetroxide is obtained.

  15. Path integrals with higher order actions: Application to realistic chemical systems

    NASA Astrophysics Data System (ADS)

    Lindoy, Lachlan P.; Huang, Gavin S.; Jordan, Meredith J. T.

    2018-02-01

    Quantum thermodynamic parameters can be determined using path integral Monte Carlo (PIMC) simulations. These simulations, however, become computationally demanding as the quantum nature of the system increases, although their efficiency can be improved by using higher order approximations to the thermal density matrix, specifically the action. Here we compare the standard, primitive approximation to the action (PA) and three higher order approximations, the Takahashi-Imada action (TIA), the Suzuki-Chin action (SCA) and the Chin action (CA). The resulting PIMC methods are applied to two realistic potential energy surfaces, for H2O and HCN-HNC, both of which are spectroscopically accurate and contain three-body interactions. We further numerically optimise, for each potential, the SCA parameter and the two free parameters in the CA, obtaining more significant improvements in efficiency than seen previously in the literature. For both H2O and HCN-HNC, accounting for all required potential and force evaluations, the optimised CA formalism is approximately twice as efficient as the TIA formalism and approximately an order of magnitude more efficient than the PA. The optimised SCA formalism shows similar efficiency gains to the CA for HCN-HNC but has similar efficiency to the TIA for H2O at low temperature. In H2O and HCN-HNC systems, the optimal value of the a1 CA parameter is approximately 1/3 , corresponding to an equal weighting of all force terms in the thermal density matrix, and similar to previous studies, the optimal α parameter in the SCA was ˜0.31. Importantly, poor choice of parameter significantly degrades the performance of the SCA and CA methods. In particular, for the CA, setting a1 = 0 is not efficient: the reduction in convergence efficiency is not offset by the lower number of force evaluations. We also find that the harmonic approximation to the CA parameters, whilst providing a fourth order approximation to the action, is not optimal for these realistic potentials: numerical optimisation leads to better approximate cancellation of the fifth order terms, with deviation between the harmonic and numerically optimised parameters more marked in the more quantum H2O system. This suggests that numerically optimising the CA or SCA parameters, which can be done at high temperature, will be important in fully realising the efficiency gains of these formalisms for realistic potentials.

  16. QCD corrections to ZZ production in gluon fusion at the LHC

    DOE PAGES

    Caola, Fabrizio; Melnikov, Kirill; Rontsch, Raoul; ...

    2015-11-23

    We compute the next-to-leading-order QCD corrections to the production of two Z-bosons in the annihilation of two gluons at the LHC. Being enhanced by a large gluon flux, these corrections provide a distinct and, potentially, the dominant part of the N 3LO QCD contributions to Z-pair production in proton collisions. The gg → ZZ annihilation is a loop-induced process that receives the dominant contribution from loops of five light quarks, that are included in our computation in the massless approximation. We find that QCD corrections increase the gg → ZZ production cross section by O(50%–100%) depending on the values ofmore » the renormalization and factorization scales used in the leading-order computation and the collider energy. Furthermore, the large corrections to the gg → ZZ channel increase the pp → ZZ cross section by about 6% to 8%, exceeding the estimated theoretical uncertainty of the recent next-to-next-to-leading-order QCD calculation.« less

  17. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Caola, Fabrizio; Melnikov, Kirill; Rontsch, Raoul

    We compute the next-to-leading-order QCD corrections to the production of two Z-bosons in the annihilation of two gluons at the LHC. Being enhanced by a large gluon flux, these corrections provide a distinct and, potentially, the dominant part of the N 3LO QCD contributions to Z-pair production in proton collisions. The gg → ZZ annihilation is a loop-induced process that receives the dominant contribution from loops of five light quarks, that are included in our computation in the massless approximation. We find that QCD corrections increase the gg → ZZ production cross section by O(50%–100%) depending on the values ofmore » the renormalization and factorization scales used in the leading-order computation and the collider energy. Furthermore, the large corrections to the gg → ZZ channel increase the pp → ZZ cross section by about 6% to 8%, exceeding the estimated theoretical uncertainty of the recent next-to-next-to-leading-order QCD calculation.« less

  18. CMB-lensing beyond the Born approximation

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Marozzi, Giovanni; Fanizza, Giuseppe; Durrer, Ruth

    2016-09-01

    We investigate the weak lensing corrections to the cosmic microwave background temperature anisotropies considering effects beyond the Born approximation. To this aim, we use the small deflection angle approximation, to connect the lensed and unlensed power spectra, via expressions for the deflection angles up to third order in the gravitational potential. While the small deflection angle approximation has the drawback to be reliable only for multipoles ℓ ∼< 2500, it allows us to consistently take into account the non-Gaussian nature of cosmological perturbation theory beyond the linear level. The contribution to the lensed temperature power spectrum coming from the non-Gaussianmore » nature of the deflection angle at higher order is a new effect which has not been taken into account in the literature so far. It turns out to be the leading contribution among the post-Born lensing corrections. On the other hand, the effect is smaller than corrections coming from non-linearities in the matter power spectrum, and its imprint on CMB lensing is too small to be seen in present experiments.« less

  19. Beyond mean-field approximations for accurate and computationally efficient models of on-lattice chemical kinetics

    NASA Astrophysics Data System (ADS)

    Pineda, M.; Stamatakis, M.

    2017-07-01

    Modeling the kinetics of surface catalyzed reactions is essential for the design of reactors and chemical processes. The majority of microkinetic models employ mean-field approximations, which lead to an approximate description of catalytic kinetics by assuming spatially uncorrelated adsorbates. On the other hand, kinetic Monte Carlo (KMC) methods provide a discrete-space continuous-time stochastic formulation that enables an accurate treatment of spatial correlations in the adlayer, but at a significant computation cost. In this work, we use the so-called cluster mean-field approach to develop higher order approximations that systematically increase the accuracy of kinetic models by treating spatial correlations at a progressively higher level of detail. We further demonstrate our approach on a reduced model for NO oxidation incorporating first nearest-neighbor lateral interactions and construct a sequence of approximations of increasingly higher accuracy, which we compare with KMC and mean-field. The latter is found to perform rather poorly, overestimating the turnover frequency by several orders of magnitude for this system. On the other hand, our approximations, while more computationally intense than the traditional mean-field treatment, still achieve tremendous computational savings compared to KMC simulations, thereby opening the way for employing them in multiscale modeling frameworks.

  20. Higher rank ABJM Wilson loops from matrix models

    DOE PAGES

    Cookmeyer, Jonathan; Liu, James T.; Pando Zayas, Leopoldo A.

    2016-11-21

    We compute the vacuum expectation values of 1/6 supersymmetric Wilson loops in higher dimensional representations of the gauge group in ABJM theory. We then present results for the m-symmetric and m-antisymmetric representations by exploiting standard matrix model techniques. At leading order, in the saddle point approximation, our expressions reproduce holographic results from both D6 and D2 branes corresponding to the antisymmetric and symmetric representations, respectively. We also compute 1/N corrections to the leading saddle point results.

  1. Decoupling of the Leading Order DGLAP Evolution Equation with Spin Dependent Structure Functions

    NASA Astrophysics Data System (ADS)

    Azadbakht, F. Teimoury; Boroun, G. R.

    2018-02-01

    We propose an analytical solution for DGLAP evolution equations with polarized splitting functions at the Leading Order (LO) approximation based on the Laplace transform method. It is shown that the DGLAP evolution equations can be decoupled completely into two second order differential equations which then are solved analytically by using the initial conditions δ FS(x,Q2)=F[partial δ FS0(x), δ FS0(x)] and {δ G}(x,Q2)=G[partial δ G0(x), δ G0(x)]. We used this method to obtain the polarized structure function of the proton as well as the polarized gluon distribution function inside the proton and compared the numerical results with experimental data of COMPASS, HERMES, and AAC'08 Collaborations. It was found that there is a good agreement between our predictions and the experiments.

  2. Higgs boson pair production at NNLO with top quark mass effects

    NASA Astrophysics Data System (ADS)

    Grazzini, M.; Heinrich, G.; Jones, S.; Kallweit, S.; Kerner, M.; Lindert, J. M.; Mazzitelli, J.

    2018-05-01

    We consider QCD radiative corrections to Higgs boson pair production through gluon fusion in proton collisions. We combine the exact next-to-leading order (NLO) contribution, which features two-loop virtual amplitudes with the full dependence on the top quark mass M t , with the next-to-next-to-leading order (NNLO) corrections computed in the large- M t approximation. The latter are improved with different reweighting techniques in order to account for finite- M t effects beyond NLO. Our reference NNLO result is obtained by combining one-loop double-real corrections with full M t dependence with suitably reweighted real-virtual and double-virtual contributions evaluated in the large- M t approximation. We present predictions for inclusive cross sections in pp collisions at √{s} = 13, 14, 27 and 100 TeV and we discuss their uncertainties due to missing M t effects. Our approximated NNLO corrections increase the NLO result by an amount ranging from +12% at √{s}=13 TeV to +7% at √{s}=100 TeV, and the residual uncertainty of the inclusive cross section from missing M t effects is estimated to be at the few percent level. Our calculation is fully differential in the Higgs boson pair and the associated jet activity: we also present predictions for various differential distributions at √{s}=14 and 100 TeV, and discuss the size of the missing M t effects, which can be larger, especially in the tails of certain observables. Our results represent the most advanced perturbative prediction available to date for this process.

  3. On the lattice dynamics of metallic hydrogen and other Coulomb systems

    NASA Technical Reports Server (NTRS)

    Beck, H.; Straus, D.

    1975-01-01

    Numerical results for the phonon spectra of metallic hydrogen and other Coulomb systems in cubic lattices are presented. In second order in the electron-ion interaction, the behavior of the dielectric function of the interacting electron gas for arguments around the seond Fermi harmonic leads to drastic Kohn anomalies and even to imaginary phonon frequencies. Third-order band-structure corrections are also calculated. Properties of self-consistent phonons and the validity of the adiabatic approximation are discussed.

  4. Nuclear magnetic shielding in boronlike ions

    NASA Astrophysics Data System (ADS)

    Volchkova, A. M.; Varentsova, A. S.; Zubova, N. A.; Agababaev, V. A.; Glazov, D. A.; Volotka, A. V.; Shabaev, V. M.; Plunien, G.

    2017-10-01

    The relativistic treatment of the nuclear magnetic shielding effect in boronlike ions is presented. The leading-order contribution of the magnetic-dipole hyperfine interaction is calculated. Along with the standard second-order perturbation theory expression, the solutions of the Dirac equation in the presence of magnetic field are employed. All methods are found to be in agreement with each other and with the previous calculations for hydrogenlike and lithiumlike ions. The effective screening potential is used to account approximately for the interelectronic interaction.

  5. Nanosecond-pulse-controlled higher-order sideband comb in a GaAs optomechanical disk resonator in the non-perturbative regime

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Xiong, Hao, E-mail: haoxiong1217@gmail.com; Si, Liu-Gang, E-mail: siliugang@gmail.com; Lü, Xin-You

    2014-10-15

    We propose an interesting scheme for tunable high-order sideband comb generation by utilizing ultrastrong optomechanical interaction in a GaAs optomechanical disk resonator beyond the perturbative approximation. We analyze the nonlinear nature of the optomechanical interaction, and give a full description of the non-perturbative effects. It is shown, within the non-perturbative regime, that high-order sideband comb with large intensities can be realized and controlled in a GaAs optomechanical disk resonator with experimentally achievable system parameters, and the non-perturbative regime leads to rich and nontrivial behavior.

  6. Revised Thomas-Fermi approximation for singular potentials

    NASA Astrophysics Data System (ADS)

    Dufty, James W.; Trickey, S. B.

    2016-08-01

    Approximations for the many-fermion free-energy density functional that include the Thomas-Fermi (TF) form for the noninteracting part lead to singular densities for singular external potentials (e.g., attractive Coulomb). This limitation of the TF approximation is addressed here by a formal map of the exact Euler equation for the density onto an equivalent TF form characterized by a modified Kohn-Sham potential. It is shown to be a "regularized" version of the Kohn-Sham potential, tempered by convolution with a finite-temperature response function. The resulting density is nonsingular, with the equilibrium properties obtained from the total free-energy functional evaluated at this density. This new representation is formally exact. Approximate expressions for the regularized potential are given to leading order in a nonlocality parameter, and the limiting behavior at high and low temperatures is described. The noninteracting part of the free energy in this approximation is the usual Thomas-Fermi functional. These results generalize and extend to finite temperatures the ground-state regularization by R. G. Parr and S. Ghosh [Proc. Natl. Acad. Sci. U.S.A. 83, 3577 (1986), 10.1073/pnas.83.11.3577] and by L. R. Pratt, G. G. Hoffman, and R. A. Harris [J. Chem. Phys. 88, 1818 (1988), 10.1063/1.454105] and formally systematize the finite-temperature regularization given by the latter authors.

  7. Nuclear parton density functions from dijet photoproduction at the EIC

    NASA Astrophysics Data System (ADS)

    Klasen, M.; Kovařík, K.

    2018-06-01

    We study the potential of dijet photoproduction measurements at a future electron-ion collider (EIC) to better constrain our present knowledge of the nuclear parton distribution functions. Based on theoretical calculations at next-to-leading order and approximate next-to-next-to-leading order of perturbative QCD, we establish the kinematic reaches for three different EIC designs, the size of the parton density function modifications for four different light and heavy nuclei from He-4 over C-12 and Fe-56 to Pb-208 with respect to the free proton, and the improvement of EIC measurements with respect to current determinations from deep-inelastic scattering and Drell-Yan data alone as well as when also considering data from existing hadron colliders.

  8. High-energy zero-norm states and symmetries of string theory.

    PubMed

    Chan, Chuan-Tsung; Ho, Pei-Ming; Lee, Jen-Chi; Teraguchi, Shunsuke; Yang, Yi

    2006-05-05

    High-energy limit of zero-norm states in the old covariant first quantized spectrum of the 26D open bosonic string, together with the assumption of a smooth behavior of string theory in this limit, are used to derive infinitely many linear relations among the leading high-energy, fixed-angle behavior of four-point functions of different string states. As a result, ratios among all high-energy scattering amplitudes of four arbitrary string states can be calculated algebraically and the leading order amplitudes can be expressed in terms of that of four tachyons as conjectured by Gross in 1988. A dual calculation can also be performed and equivalent results are obtained by taking the high-energy limit of Virasoro constraints. Finally, we compute all high-energy scattering amplitudes of three tachyons and one massive state at the leading order by saddle-point approximation to verify our results.

  9. Helping Students Who Are Deaf or Hard of Hearing Succeed

    ERIC Educational Resources Information Center

    Luckner, John L.; Slike, Samuel B.; Johnson, Harold

    2012-01-01

    A hearing loss of any type has the potential to adversely impact development leading to language, literacy, social, and academic delays. Currently, approximately 87% of students who are deaf or hard of hearing spend at least part of each day in a general education classroom. In order to optimally benefit from receiving educational services in the…

  10. Quasi-elastic nuclear scattering at high energies

    NASA Technical Reports Server (NTRS)

    Cucinotta, Francis A.; Townsend, Lawrence W.; Wilson, John W.

    1992-01-01

    The quasi-elastic scattering of two nuclei is considered in the high-energy optical model. Energy loss and momentum transfer spectra for projectile ions are evaluated in terms of an inelastic multiple-scattering series corresponding to multiple knockout of target nucleons. The leading-order correction to the coherent projectile approximation is evaluated. Calculations are compared with experiments.

  11. Thermoelectrics in Coulomb-coupled quantum dots: Cotunneling and energy-dependent lead couplings

    NASA Astrophysics Data System (ADS)

    Walldorf, Nicklas; Jauho, Antti-Pekka; Kaasbjerg, Kristen

    2017-09-01

    We study thermoelectric effects in Coulomb-coupled quantum-dot (CCQD) systems beyond lowest-order tunneling processes and the often applied wide-band approximation. To this end, we present a master-equation (ME) approach based on a perturbative T -matrix calculation of the charge and heat tunneling rates and transport currents. Applying the method to transport through a noninteracting single-level QD, we demonstrate excellent agreement with the Landauer-Büttiker theory when higher-order (cotunneling) processes are included in the ME. Next, we study the effect of cotunneling and energy-dependent lead couplings on the heat currents in a system of two CCQDs. We find that cotunneling processes (i) can dominate the off-resonant heat currents at low temperature and bias compared to the interdot interaction, and (ii) give rise to a pronounced reduction of the cooling power achievable with the recently demonstrated Maxwell's demon cooling mechanism. Furthermore, we demonstrate that the cooling power can be boosted significantly by carefully engineering the energy dependence of the lead couplings to filter out undesired transport processes. Our findings emphasize the importance of higher-order cotunneling processes as well as engineered energy-dependent lead couplings in the optimization of the thermoelectric performance of CCQD systems.

  12. Revisiting the Landau fluid closure.

    NASA Astrophysics Data System (ADS)

    Hunana, P.; Zank, G. P.; Webb, G. M.; Adhikari, L.

    2017-12-01

    Advanced fluid models that are much closer to the full kinetic description than the usual magnetohydrodynamic description are a very useful tool for studying astrophysical plasmas and for interpreting solar wind observational data. The development of advanced fluid models that contain certain kinetic effects is complicated and has attracted much attention over the past years. Here we focus on fluid models that incorporate the simplest possible forms of Landau damping, derived from linear kinetic theory expanded about a leading-order (gyrotropic) bi-Maxwellian distribution function f_0, under the approximation that the perturbed distribution function f_1 is gyrotropic as well. Specifically, we focus on various Pade approximants to the usual plasma response function (and to the plasma dispersion function) and examine possibilities that lead to a closure of the linear kinetic hierarchy of fluid moments. We present re-examination of the simplest Landau fluid closures.

  13. Second-order dissipative hydrodynamics for plasma with chiral asymmetry and vorticity

    NASA Astrophysics Data System (ADS)

    Gorbar, E. V.; Rybalka, D. O.; Shovkovy, I. A.

    2017-05-01

    By making use of the chiral kinetic theory in the relaxation-time approximation, we derive an Israel-Stewart type formulation of the hydrodynamic equations for a chiral relativistic plasma made of neutral particles (e.g., neutrinos). The effects of chiral asymmetry are captured by including an additional continuity equation for the axial charge, as well as the leading-order quantum corrections due to the spin of particles. In a formulation of the chiral kinetic theory used, we introduce a symmetric form of the energy-momentum tensor that is suitable for the description of a weakly nonuniform chiral plasma. By construction, the energy and momentum are conserved to the same leading order in the Planck constant as the kinetic equation itself. By making use of such a chiral kinetic theory and the Chapman-Enskog approach, we obtain a set of second-order dissipative hydrodynamic equations. The effects of the fluid vorticity and velocity fluctuations on the dispersion relations of chiral vortical waves are analyzed.

  14. A Theoretical Understanding of Circular Polarization Memory in Random Media

    NASA Astrophysics Data System (ADS)

    Dark, Julia

    Radiative transport theory describes the propagation of light in random media that absorb, scatter, and emit radiation. To describe the propagation of light, the full polarization state is quantified using the Stokes parameters. For the sake of mathematical convenience, the polarization state of light is often neglected leading to the scalar radiative transport equation for the intensity only. For scalar transport theory, there is a well-established body of literature on numerical and analytic approximations to the radiative transport equation. We extend the scalar theory to the vector radiative transport equation (vRTE). In particular, we are interested in the theoretical basis for a phenomena called circular polarization memory. Circular polarization memory is the physical phenomena whereby circular polarization retains its ellipticity and handedness when propagating in random media. This is in contrast to the propagation of linear polarization in random media, which depolarizes at a faster rate, and specular reflection of circular polarization, whereby the circular polarization handedness flips. We investigate two limits that are of known interest in the phenomena of circular polarization memory. The first limit we investigate is that of forward-peaked scattering, i.e. the limit where most scattering events occur in the forward or near-forward directions. The second limit we consider is that of strong scattering and weak absorption. In the forward-peaked scattering limit we approximate the vRTE by a system of partial differential equations motivated by the scalar Fokker-Planck approximation. We call the leading order approximation the vector Fokker-Planck approximation. The vector Fokker Planck approximation predicts that strongly forward-peaked media exhibit circular polarization memory where the strength of the effect can be calculated from the expansion of the scattering matrix in special functions. In addition, we find in this limit that total intensity, linear polarization, and circular polarization decouple. From this result we conclude, that in the Fokker-Planck limit the scalar approximation is an appropriate leading order approximation. In the strong scattering and weak absorbing limit the vector radiative transport equation can be analyzed using boundary layer theory. In this case, the problem of light scattering in an optically thick medium is reduced to a 1D vRTE near the boundary and a 3D diffusion equation in the interior. We develop and implement a numerical solver for the boundary layer problem by using a discrete ordinate solver in the boundary layer and a spectral method to solve the diffusion approximation in the interior. We implement the method in Fortran 95 with external dependencies on BLAS, LAPACK, and FFTW. By analyzing the spectrum of the discretized vRTE in the boundary layer, we are able to predict the presence of circular polarization memory in a given medium.

  15. Generalized vector calculus on convex domain

    NASA Astrophysics Data System (ADS)

    Agrawal, Om P.; Xu, Yufeng

    2015-06-01

    In this paper, we apply recently proposed generalized integral and differential operators to develop generalized vector calculus and generalized variational calculus for problems defined over a convex domain. In particular, we present some generalization of Green's and Gauss divergence theorems involving some new operators, and apply these theorems to generalized variational calculus. For fractional power kernels, the formulation leads to fractional vector calculus and fractional variational calculus for problems defined over a convex domain. In special cases, when certain parameters take integer values, we obtain formulations for integer order problems. Two examples are presented to demonstrate applications of the generalized variational calculus which utilize the generalized vector calculus developed in the paper. The first example leads to a generalized partial differential equation and the second example leads to a generalized eigenvalue problem, both in two dimensional convex domains. We solve the generalized partial differential equation by using polynomial approximation. A special case of the second example is a generalized isoperimetric problem. We find an approximate solution to this problem. Many physical problems containing integer order integrals and derivatives are defined over arbitrary domains. We speculate that future problems containing fractional and generalized integrals and derivatives in fractional mechanics will be defined over arbitrary domains, and therefore, a general variational calculus incorporating a general vector calculus will be needed for these problems. This research is our first attempt in that direction.

  16. On the derivation of the semiclassical approximation to the quantum propagator

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Fischer, Stefan G., E-mail: stefan.fischer@physik.uni-freiburg.de; Buchleitner, Andreas

    2015-07-15

    In order to rigorously derive the amplitude factor of the semiclassical approximation to the quantum propagator, we extend an existing method originally devised to evaluate Gaussian path-integral expressions. Using a result which relates the determinant of symmetric block-tridiagonal matrices to the determinants of their blocks, two difference equations are obtained. The first one allows to establish the connection of the amplitude factor to Jacobi’s accessory equations in the continuous-time limit, while the second one leads to an additional factor which, however, contributes to the final result only in exceptional cases. In order to demonstrate the wide applicability of these differencemore » equations, we treat explicitly the case where the time-sliced Lagrangian is written in generalized coordinates, for which a general derivation has so far been unavailable.« less

  17. A reduced-order model from high-dimensional frictional hysteresis

    PubMed Central

    Biswas, Saurabh; Chatterjee, Anindya

    2014-01-01

    Hysteresis in material behaviour includes both signum nonlinearities as well as high dimensionality. Available models for component-level hysteretic behaviour are empirical. Here, we derive a low-order model for rate-independent hysteresis from a high-dimensional massless frictional system. The original system, being given in terms of signs of velocities, is first solved incrementally using a linear complementarity problem formulation. From this numerical solution, to develop a reduced-order model, basis vectors are chosen using the singular value decomposition. The slip direction in generalized coordinates is identified as the minimizer of a dissipation-related function. That function includes terms for frictional dissipation through signum nonlinearities at many friction sites. Luckily, it allows a convenient analytical approximation. Upon solution of the approximated minimization problem, the slip direction is found. A final evolution equation for a few states is then obtained that gives a good match with the full solution. The model obtained here may lead to new insights into hysteresis as well as better empirical modelling thereof. PMID:24910522

  18. The magnetic lead field theorem in the quasi-static approximation and its use for magnetoencephalography forward calculation in realistic volume conductors.

    PubMed

    Nolte, Guido

    2003-11-21

    The equation for the magnetic lead field for a given magnetoencephalography (MEG) channel is well known for arbitrary frequencies omega but is not directly applicable to MEG in the quasi-static approximation. In this paper we derive an equation for omega = 0 starting from the very definition of the lead field instead of using Helmholtz's reciprocity theorems. The results are (a) the transpose of the conductivity times the lead field is divergence-free, and (b) the lead field differs from the one in any other volume conductor by a gradient of a scalar function. Consequently, for a piecewise homogeneous and isotropic volume conductor, the lead field is always tangential at the outermost surface. Based on this theoretical result, we formulated a simple and fast method for the MEG forward calculation for one shell of arbitrary shape: we correct the corresponding lead field for a spherical volume conductor by a superposition of basis functions, gradients of harmonic functions constructed here from spherical harmonics, with coefficients fitted to the boundary conditions. The algorithm was tested for a prolate spheroid of realistic shape for which the analytical solution is known. For high order in the expansion, we found the solutions to be essentially exact and for reasonable accuracies much fewer multiplications are needed than in typical implementations of the boundary element methods. The generalization to more shells is straightforward.

  19. Families Support to Transistion: A Systematic Review of the Evidence. Research Report

    ERIC Educational Resources Information Center

    Søndergaard, Susanne; Cox, Kate; Silfversten, Erik; Anderson, Brent; Meads, Catherine; Schaefer, Agnes Gereben; Larkin, Jody

    2016-01-01

    Each year, approximately 17,000 personnel leave the UK Armed Forces and return to civilian life. The Forces in Mind Trust (FiMT) has called for better transition support in order to assist Service leavers and their families in leading successful civilian lives. FiMT conducted a stakeholder engagement programme in 2015 to identify areas where…

  20. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Buckley, Andy; /Edinburgh U.; Butterworth, Jonathan

    We review the physics basis, main features and use of general-purpose Monte Carlo event generators for the simulation of proton-proton collisions at the Large Hadron Collider. Topics included are: the generation of hard-scattering matrix elements for processes of interest, at both leading and next-to-leading QCD perturbative order; their matching to approximate treatments of higher orders based on the showering approximation; the parton and dipole shower formulations; parton distribution functions for event generators; non-perturbative aspects such as soft QCD collisions, the underlying event and diffractive processes; the string and cluster models for hadron formation; the treatment of hadron and tau decays;more » the inclusion of QED radiation and beyond-Standard-Model processes. We describe the principal features of the Ariadne, Herwig++, Pythia 8 and Sherpa generators, together with the Rivet and Professor validation and tuning tools, and discuss the physics philosophy behind the proper use of these generators and tools. This review is aimed at phenomenologists wishing to understand better how parton-level predictions are translated into hadron-level events as well as experimentalists wanting a deeper insight into the tools available for signal and background simulation at the LHC.« less

  1. Multipolar electromagnetic fields around neutron stars: general-relativistic vacuum solutions

    NASA Astrophysics Data System (ADS)

    Pétri, J.

    2017-12-01

    Magnetic fields inside and around neutron stars are at the heart of pulsar magnetospheric activity. Strong magnetic fields are responsible for quantum effects, an essential ingredient to produce leptonic pairs and the subsequent broad-band radiation. The variety of electromagnetic field topologies could lead to the observed diversity of neutron star classes. Thus, it is important to include multipolar components to a presumably dominant dipolar magnetic field. Exact analytical solutions for these multipoles in Newtonian gravity have been computed in recent literature. However, flat space-time is not adequate to describe physics in the immediate surroundings of neutron stars. We generalize the multipole expressions to the strong gravity regime by using a slowly rotating metric approximation such as the one expected around neutron stars. Approximate formulae for the electromagnetic field including frame dragging are computed from which we estimate the Poynting flux and the braking index. Corrections to leading order in compactness and spin parameter are presented. As far as spin-down luminosity is concerned, it is shown that frame dragging remains irrelevant. For high-order multipoles starting from the quadrupole, the electric part can radiate more efficiently than the magnetic part. Both analytical and numerical tools are employed.

  2. High-Accuracy Comparison Between the Post-Newtonian and Self-Force Dynamics of Black-Hole Binaries

    NASA Astrophysics Data System (ADS)

    Blanchet, Luc; Detweiler, Steven; Le Tiec, Alexandre; Whiting, Bernard F.

    The relativistic motion of a compact binary system moving in circular orbit is investigated using the post-Newtonian (PN) approximation and the perturbative self-force (SF) formalism. A particular gauge-invariant observable quantity is computed as a function of the binary's orbital frequency. The conservative effect induced by the gravitational SF is obtained numerically with high precision, and compared to the PN prediction developed to high order. The PN calculation involves the computation of the 3PN regularized metric at the location of the particle. Its divergent self-field is regularized by means of dimensional regularization. The poles ∝ {(d - 3)}^{-1} that occur within dimensional regularization at the 3PN order disappear from the final gauge-invariant result. The leading 4PN and next-to-leading 5PN conservative logarithmic contributions originating from gravitational wave tails are also obtained. Making use of these exact PN results, some previously unknown PN coefficients are measured up to the very high 7PN order by fitting to the numerical SF data. Using just the 2PN and new logarithmic terms, the value of the 3PN coefficient is also confirmed numerically with very high precision. The consistency of this cross-cultural comparison provides a crucial test of the very different regularization methods used in both SF and PN formalisms, and illustrates the complementarity of these approximation schemes when modeling compact binary systems.

  3. Flux-corrected transport algorithms for continuous Galerkin methods based on high order Bernstein finite elements

    NASA Astrophysics Data System (ADS)

    Lohmann, Christoph; Kuzmin, Dmitri; Shadid, John N.; Mabuza, Sibusiso

    2017-09-01

    This work extends the flux-corrected transport (FCT) methodology to arbitrary order continuous finite element discretizations of scalar conservation laws on simplex meshes. Using Bernstein polynomials as local basis functions, we constrain the total variation of the numerical solution by imposing local discrete maximum principles on the Bézier net. The design of accuracy-preserving FCT schemes for high order Bernstein-Bézier finite elements requires the development of new algorithms and/or generalization of limiting techniques tailored for linear and multilinear Lagrange elements. In this paper, we propose (i) a new discrete upwinding strategy leading to local extremum bounded low order approximations with compact stencils, (ii) high order variational stabilization based on the difference between two gradient approximations, and (iii) new localized limiting techniques for antidiffusive element contributions. The optional use of a smoothness indicator, based on a second derivative test, makes it possible to potentially avoid unnecessary limiting at smooth extrema and achieve optimal convergence rates for problems with smooth solutions. The accuracy of the proposed schemes is assessed in numerical studies for the linear transport equation in 1D and 2D.

  4. Parametric Excitation of Marangoni Instability in a Heated Thin Layer Covered by Insoluble Surfactant

    NASA Astrophysics Data System (ADS)

    Mikishev, Alexander B.; Nepomnyashchy, Alexander A.

    2018-05-01

    The paper presents the analysis of the impact of vertical periodic vibrations on the long-wavelength Marangoni instability in a liquid layer with poorly conducting boundaries in the presence of insoluble surfactant on the deformable gas-liquid interface. The layer is subject to a uniform transverse temperature gradient. Linear stability analysis is performed in order to find critical values of Marangoni numbers for both monotonic and oscillatory instability modes. Longwave asymptotic expansions are used. At the leading order, the critical values are independent on vibration parameters; at the next order of approximation we obtained the rise of stability thresholds due to vibration.

  5. Decoupling the NLO-coupled QED⊗QCD, DGLAP evolution equations, using Laplace transform method

    NASA Astrophysics Data System (ADS)

    Mottaghizadeh, Marzieh; Eslami, Parvin; Taghavi-Shahri, Fatemeh

    2017-05-01

    We analytically solved the QED⊗QCD-coupled DGLAP evolution equations at leading order (LO) quantum electrodynamics (QED) and next-to-leading order (NLO) quantum chromodynamics (QCD) approximations, using the Laplace transform method and then computed the proton structure function in terms of the unpolarized parton distribution functions. Our analytical solutions for parton densities are in good agreement with those from CT14QED (1.2952 < Q2 < 1010) (Ref. 6) global parametrizations and APFEL (A PDF Evolution Library) (2 < Q2 < 108) (Ref. 4). We also compared the proton structure function, F2p(x,Q2), with the experimental data released by the ZEUS and H1 collaborations at HERA. There is a nice agreement between them in the range of low and high x and Q2.

  6. Quantum search algorithms on a regular lattice

    NASA Astrophysics Data System (ADS)

    Hein, Birgit; Tanner, Gregor

    2010-07-01

    Quantum algorithms for searching for one or more marked items on a d-dimensional lattice provide an extension of Grover’s search algorithm including a spatial component. We demonstrate that these lattice search algorithms can be viewed in terms of the level dynamics near an avoided crossing of a one-parameter family of quantum random walks. We give approximations for both the level splitting at the avoided crossing and the effectively two-dimensional subspace of the full Hilbert space spanning the level crossing. This makes it possible to give the leading order behavior for the search time and the localization probability in the limit of large lattice size including the leading order coefficients. For d=2 and d=3, these coefficients are calculated explicitly. Closed form expressions are given for higher dimensions.

  7. Inclusive prompt photon production in electron-nucleus scattering at small x

    NASA Astrophysics Data System (ADS)

    Roy, Kaushik; Venugopalan, Raju

    2018-05-01

    We compute the differential cross-section for inclusive prompt photon production in deeply inelastic scattering (DIS) of electrons on nuclei at small x in the framework of the Color Glass Condensate (CGC) effective theory. The leading order (LO) computation in this framework resums leading logarithms in x as well as power corrections to all orders in Q s, A 2 / Q 2, where Q s, A ( x) is the nuclear saturation scale. This LO result is proportional to universal dipole and quadrupole Wilson line correlators in the nucleus. In the soft photon limit, the Low-Burnett-Kroll theorem allows us to recover existing results on inclusive DIS dijet production. The k ⊥ and collinearly factorized expressions for prompt photon production in DIS are also recovered in a leading twist approximation to our result. In the latter case, our result corresponds to the dominant next-to-leading order (NLO) perturbative QCD contribution at small x. We next discuss the computation of the NLO corrections to inclusive prompt photon production in the CGC framework. In particular, we emphasize the advantages for higher order computations in inclusive photon production, and for fully inclusive DIS, arising from the simple momentum space structure of the dressed quark and gluon "shock wave" propagators in the "wrong" light cone gauge A - = 0 for a nucleus moving with P N + → ∞.

  8. Communication: Biological applications of coupled-cluster frozen-density embedding

    NASA Astrophysics Data System (ADS)

    Heuser, Johannes; Höfener, Sebastian

    2018-04-01

    We report the implementation of the Laplace-transform scaled opposite-spin (LT-SOS) resolution-of-the-identity second-order approximate coupled-cluster singles and doubles (RICC2) combined with frozen-density embedding for excitation energies and molecular properties. In the present work, we furthermore employ the Hartree-Fock density for the interaction energy leading to a simplified Lagrangian which is linear in the Lagrangian multipliers. This approximation has the key advantage of a decoupling of the coupled-cluster amplitude and multipliers, leading also to a significant reduction in computation time. Using the new simplified Lagrangian in combination with efficient wavefunction models such as RICC2 or LT-SOS-RICC2 and density-functional theory (DFT) for the environment molecules (CC2-in-DFT) enables the efficient study of biological applications such as the rhodopsin and visual cone pigments using ab initio methods as routine applications.

  9. Effect of initial phase on error in electron energy obtained using paraxial approximation for a focused laser pulse in vacuum

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Singh, Kunwar Pal, E-mail: k-psingh@yahoo.com; Department of Physics, Shri Venkateshwara University, Gajraula, Amroha, Uttar Pradesh 244236; Arya, Rashmi

    2015-09-14

    We have investigated the effect of initial phase on error in electron energy obtained using paraxial approximation to study electron acceleration by a focused laser pulse in vacuum using a three dimensional test-particle simulation code. The error is obtained by comparing the energy of the electron for paraxial approximation and seventh-order correction description of the fields of Gaussian laser. The paraxial approximation predicts wrong laser divergence and wrong electron escape time from the pulse which leads to prediction of higher energy. The error shows strong phase dependence for the electrons lying along the axis of the laser for linearly polarizedmore » laser pulse. The relative error may be significant for some specific values of initial phase even at moderate values of laser spot sizes. The error does not show initial phase dependence for a circularly laser pulse.« less

  10. Approximate techniques of structural reanalysis

    NASA Technical Reports Server (NTRS)

    Noor, A. K.; Lowder, H. E.

    1974-01-01

    A study is made of two approximate techniques for structural reanalysis. These include Taylor series expansions for response variables in terms of design variables and the reduced-basis method. In addition, modifications to these techniques are proposed to overcome some of their major drawbacks. The modifications include a rational approach to the selection of the reduced-basis vectors and the use of Taylor series approximation in an iterative process. For the reduced basis a normalized set of vectors is chosen which consists of the original analyzed design and the first-order sensitivity analysis vectors. The use of the Taylor series approximation as a first (initial) estimate in an iterative process, can lead to significant improvements in accuracy, even with one iteration cycle. Therefore, the range of applicability of the reanalysis technique can be extended. Numerical examples are presented which demonstrate the gain in accuracy obtained by using the proposed modification techniques, for a wide range of variations in the design variables.

  11. Stochastic process approximation for recursive estimation with guaranteed bound on the error covariance

    NASA Technical Reports Server (NTRS)

    Menga, G.

    1975-01-01

    An approach, is proposed for the design of approximate, fixed order, discrete time realizations of stochastic processes from the output covariance over a finite time interval, was proposed. No restrictive assumptions are imposed on the process; it can be nonstationary and lead to a high dimension realization. Classes of fixed order models are defined, having the joint covariance matrix of the combined vector of the outputs in the interval of definition greater or equal than the process covariance; (the difference matrix is nonnegative definite). The design is achieved by minimizing, in one of those classes, a measure of the approximation between the model and the process evaluated by the trace of the difference of the respective covariance matrices. Models belonging to these classes have the notable property that, under the same measurement system and estimator structure, the output estimation error covariance matrix computed on the model is an upper bound of the corresponding covariance on the real process. An application of the approach is illustrated by the modeling of random meteorological wind profiles from the statistical analysis of historical data.

  12. Fourth order difference methods for hyperbolic IBVP's

    NASA Technical Reports Server (NTRS)

    Gustafsson, Bertil; Olsson, Pelle

    1994-01-01

    Fourth order difference approximations of initial-boundary value problems for hyperbolic partial differential equations are considered. We use the method of lines approach with both explicit and compact implicit difference operators in space. The explicit operator satisfies an energy estimate leading to strict stability. For the implicit operator we develop boundary conditions and give a complete proof of strong stability using the Laplace transform technique. We also present numerical experiments for the linear advection equation and Burgers' equation with discontinuities in the solution or in its derivative. The first equation is used for modeling contact discontinuities in fluid dynamics, the second one for modeling shocks and rarefaction waves. The time discretization is done with a third order Runge-Kutta TVD method. For solutions with discontinuities in the solution itself we add a filter based on second order viscosity. In case of the non-linear Burger's equation we use a flux splitting technique that results in an energy estimate for certain different approximations, in which case also an entropy condition is fulfilled. In particular we shall demonstrate that the unsplit conservative form produces a non-physical shock instead of the physically correct rarefaction wave. In the numerical experiments we compare our fourth order methods with a standard second order one and with a third order TVD-method. The results show that the fourth order methods are the only ones that give good results for all the considered test problems.

  13. Two-Term Asymptotic Approximation of a Cardiac Restitution Curve*

    PubMed Central

    Cain, John W.; Schaeffer, David G.

    2007-01-01

    If spatial extent is neglected, ionic models of cardiac cells consist of systems of ordinary differential equations (ODEs) which have the property of excitability, i.e., a brief stimulus produces a prolonged evolution (called an action potential in the cardiac context) before the eventual return to equilibrium. Under repeated stimulation, or pacing, cardiac tissue exhibits electrical restitution: the steady-state action potential duration (APD) at a given pacing period B shortens as B is decreased. Independent of ionic models, restitution is often modeled phenomenologically by a one-dimensional mapping of the form APDnext = f(B – APDprevious). Under some circumstances, a restitution function f can be derived as an asymptotic approximation to the behavior of an ionic model. In this paper, extending previous work, we derive the next term in such an asymptotic approximation for a particular ionic model consisting of two ODEs. The two-term approximation exhibits excellent quantitative agreement with the actual restitution curve, whereas the leading-order approximation significantly underestimates actual APD values. PMID:18080006

  14. Local CC2 response method based on the Laplace transform: analytic energy gradients for ground and excited states.

    PubMed

    Ledermüller, Katrin; Schütz, Martin

    2014-04-28

    A multistate local CC2 response method for the calculation of analytic energy gradients with respect to nuclear displacements is presented for ground and electronically excited states. The gradient enables the search for equilibrium geometries of extended molecular systems. Laplace transform is used to partition the eigenvalue problem in order to obtain an effective singles eigenvalue problem and adaptive, state-specific local approximations. This leads to an approximation in the energy Lagrangian, which however is shown (by comparison with the corresponding gradient method without Laplace transform) to be of no concern for geometry optimizations. The accuracy of the local approximation is tested and the efficiency of the new code is demonstrated by application calculations devoted to a photocatalytic decarboxylation process of present interest.

  15. Second derivatives for approximate spin projection methods

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Thompson, Lee M.; Hratchian, Hrant P., E-mail: hhratchian@ucmerced.edu

    2015-02-07

    The use of broken-symmetry electronic structure methods is required in order to obtain correct behavior of electronically strained open-shell systems, such as transition states, biradicals, and transition metals. This approach often has issues with spin contamination, which can lead to significant errors in predicted energies, geometries, and properties. Approximate projection schemes are able to correct for spin contamination and can often yield improved results. To fully make use of these methods and to carry out exploration of the potential energy surface, it is desirable to develop an efficient second energy derivative theory. In this paper, we formulate the analytical secondmore » derivatives for the Yamaguchi approximate projection scheme, building on recent work that has yielded an efficient implementation of the analytical first derivatives.« less

  16. Exact and approximate Fourier rebinning algorithms for the solution of the data truncation problem in 3-D PET.

    PubMed

    Bouallègue, Fayçal Ben; Crouzet, Jean-François; Comtat, Claude; Fourcade, Marjolaine; Mohammadi, Bijan; Mariano-Goulart, Denis

    2007-07-01

    This paper presents an extended 3-D exact rebinning formula in the Fourier space that leads to an iterative reprojection algorithm (iterative FOREPROJ), which enables the estimation of unmeasured oblique projection data on the basis of the whole set of measured data. In first approximation, this analytical formula also leads to an extended Fourier rebinning equation that is the basis for an approximate reprojection algorithm (extended FORE). These algorithms were evaluated on numerically simulated 3-D positron emission tomography (PET) data for the solution of the truncation problem, i.e., the estimation of the missing portions in the oblique projection data, before the application of algorithms that require complete projection data such as some rebinning methods (FOREX) or 3-D reconstruction algorithms (3DRP or direct Fourier methods). By taking advantage of all the 3-D data statistics, the iterative FOREPROJ reprojection provides a reliable alternative to the classical FOREPROJ method, which only exploits the low-statistics nonoblique data. It significantly improves the quality of the external reconstructed slices without loss of spatial resolution. As for the approximate extended FORE algorithm, it clearly exhibits limitations due to axial interpolations, but will require clinical studies with more realistic measured data in order to decide on its pertinence.

  17. Hessian eigenvalue distribution in a random Gaussian landscape

    NASA Astrophysics Data System (ADS)

    Yamada, Masaki; Vilenkin, Alexander

    2018-03-01

    The energy landscape of multiverse cosmology is often modeled by a multi-dimensional random Gaussian potential. The physical predictions of such models crucially depend on the eigenvalue distribution of the Hessian matrix at potential minima. In particular, the stability of vacua and the dynamics of slow-roll inflation are sensitive to the magnitude of the smallest eigenvalues. The Hessian eigenvalue distribution has been studied earlier, using the saddle point approximation, in the leading order of 1/ N expansion, where N is the dimensionality of the landscape. This approximation, however, is insufficient for the small eigenvalue end of the spectrum, where sub-leading terms play a significant role. We extend the saddle point method to account for the sub-leading contributions. We also develop a new approach, where the eigenvalue distribution is found as an equilibrium distribution at the endpoint of a stochastic process (Dyson Brownian motion). The results of the two approaches are consistent in cases where both methods are applicable. We discuss the implications of our results for vacuum stability and slow-roll inflation in the landscape.

  18. Temperature scaling in a dense vibrofluidized granular material.

    PubMed

    Sunthar, P; Kumaran, V

    1999-08-01

    The leading order "temperature" of a dense two-dimensional granular material fluidized by external vibrations is determined. The grain interactions are characterized by inelastic collisions, but the coefficient of restitution is considered to be close to 1, so that the dissipation of energy during a collision is small compared to the average energy of a particle. An asymptotic solution is obtained where the particles are considered to be elastic in the leading approximation. The velocity distribution is a Maxwell-Boltzmann distribution in the leading approximation. The density profile is determined by solving the momentum balance equation in the vertical direction, where the relation between the pressure and density is provided by the virial equation of state. The temperature is determined by relating the source of energy due to the vibrating surface and the energy dissipation due to inelastic collisions. The predictions of the present analysis show good agreement with simulation results at higher densities where theories for a dilute vibrated granular material, with the pressure-density relation provided by the ideal gas law, are in error.

  19. Radiative corrections to double-Dalitz decays revisited

    NASA Astrophysics Data System (ADS)

    Kampf, Karol; Novotný, Jiři; Sanchez-Puertas, Pablo

    2018-03-01

    In this study, we revisit and complete the full next-to-leading order corrections to pseudoscalar double-Dalitz decays within the soft-photon approximation. Comparing to the previous study, we find small differences, which are nevertheless relevant for extracting information about the pseudoscalar transition form factors. Concerning the latter, these processes could offer the opportunity to test them—for the first time—in their double-virtual regime.

  20. H2-norm for mesh optimization with application to electro-thermal modeling of an electric wire in automotive context

    NASA Astrophysics Data System (ADS)

    Chevrié, Mathieu; Farges, Christophe; Sabatier, Jocelyn; Guillemard, Franck; Pradere, Laetitia

    2017-04-01

    In automotive application field, reducing electric conductors dimensions is significant to decrease the embedded mass and the manufacturing costs. It is thus essential to develop tools to optimize the wire diameter according to thermal constraints and protection algorithms to maintain a high level of safety. In order to develop such tools and algorithms, accurate electro-thermal models of electric wires are required. However, thermal equation solutions lead to implicit fractional transfer functions involving an exponential that cannot be embedded in a car calculator. This paper thus proposes an integer order transfer function approximation methodology based on a spatial discretization for this class of fractional transfer functions. Moreover, the H2-norm is used to minimize approximation error. Accuracy of the proposed approach is confirmed with measured data on a 1.5 mm2 wire implemented in a dedicated test bench.

  1. Anomalies in the 1D Anderson model: Beyond the band-centre and band-edge cases

    NASA Astrophysics Data System (ADS)

    Tessieri, L.; Izrailev, F. M.

    2018-03-01

    We consider the one-dimensional Anderson model with weak disorder. Using the Hamiltonian map approach, we analyse the validity of the random-phase approximation for resonant values of the energy, E = 2 cos(πr) , with r a rational number. We expand the invariant measure of the phase variable in powers of the disorder strength and we show that, contrary to what happens at the centre and at the edges of the band, for all other resonant energies the leading term of the invariant measure is uniform. When higher-order terms are taken into account, a modulation of the invariant measure appears for all resonant values of the energy. This implies that, when the localisation length is computed within the second-order approximation in the disorder strength, the Thouless formula is valid everywhere except at the band centre and at the band edges.

  2. Trends in lead concentrations in major US rivers and their relation to historical changes in gasoline-lead consumption, by Richard B. Alexander and Richard A. Smith

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Flegal, A.R.; Coale, K.H.

    1989-12-01

    The sequential development of trace metal clean techniques has resulted in a systematic decrease in reported lead concentrations in the ocean. Similar decreases have been observed in reports of lead concentrations in fresh water. This was illustrated by the changes in reported baseline concentrations of lead in Lake Huron. However, even the latest (1980) of those concentrations (19 ng/L) appears to be erroneously high based on recent measurements of lead concentrations in the Great Lakes. Lead concentrations in surface waters in the center of Lake Ontario are < 2 ng/L or one order of magnitude lower than the reported baselinemore » concentration of Lake Huron in 1980. Corresponding concentrations of lead in surface waters of Lake Huron should be equal to or less than those in Lake Ontario. Anthropogenic lead fluxes to Lake Huron (621 metric tons per year) and Lake Ontario (592 metric tons per year) are comparable, while the assimilative capacity of Lake Huron is two-fold greater than that of Lake Ontario. Moreover, the atmospheric flux of industrial lead aerosols to surface waters in Lake Huron is approximately one half of the flux in Lake Ontario. Therefore, if removal rates are similar in these two lakes, the authors expect the baseline concentration of lead in Lake Huron to be {le} 2 ng/L or one order of magnitude lower than the 1980 baseline concentration. Concentrations in remote fresh water systems in North America, where inputs of industrial lead aerosols are orders of magnitude lower should also be < 2 ng/L. The preceding measurements and projected concentrations of lead in fresh water systems in North America are of note in light of some recent reports on the decrease of lead in natural waters within the US. Those reports are questionable, in spite of other reports of decreasing lead concentrations in the Mississippi River and North Atlantic.« less

  3. Towards next-to-next-to-leading-log accuracy for the width difference in the {B}_s-{\\overline{B}}_s system: fermionic contributions to order ( m c /m b )0 and ( m c /m b )1

    NASA Astrophysics Data System (ADS)

    Asatrian, H. M.; Hovhannisyan, A.; Nierste, U.; Yeghiazaryan, A.

    2017-10-01

    We calculate a class of three-loop Feynman diagrams which contribute to the next-to-next-to-leading logarithmic approximation for the width difference ΔΓ s in the {B}_s-{\\overline{B}}_s system. The considered diagrams contain a closed fermion loop in a gluon propagator and constitute the order α s 2 N f , where N f is the number of light quarks. Our results entail a considerable correction in that order, if ΔΓ s is expressed in terms of the pole mass of the bottom quark. If the \\overline{MS} scheme is used instead, the correction is much smaller. As a result, we find a decrease of the scheme dependence. Our result also indicates that the usually quoted value of the NLO renormalization scale dependence underestimates the perturbative error.

  4. Stability of azimuthal-angle observables under higher order corrections in inclusive three-jet production

    NASA Astrophysics Data System (ADS)

    Caporale, F.; Celiberto, F. G.; Chachamis, G.; Gómez, D. Gordo; Vera, A. Sabio

    2017-04-01

    Recently, a new family of observables consisting of azimuthal-angle generalized ratios was proposed in a kinematical setup that resembles the usual Mueller-Navelet jets but with an additional tagged jet in the central region of rapidity. Nontagged minijet activity between the three jets can affect significantly the azimuthal angle orientation of the jets and is accounted for by the introduction of two Balitsky-Fadin-Kuraev- Lipatov (BFKL) gluon Green functions. Here, we calculate the, presumably, most relevant higher order corrections to the observables by now convoluting the three leading order jet vertices with two gluon Green functions at next-to-leading logarithmic approximation. The corrections appear to be mostly moderate, giving us confidence that the recently proposed observables are actually an excellent way to probe the BFKL dynamics at the LHC. Furthermore, we allow for the jets to take values in different rapidity bins in various configurations such that a comparison between our predictions and the experimental data is a straightforward task.

  5. A semi-analytical method for the computation of the Lyapunov exponents of fractional-order systems

    NASA Astrophysics Data System (ADS)

    Caponetto, Riccardo; Fazzino, Stefano

    2013-01-01

    Fractional-order differential equations are interesting for their applications in the construction of mathematical models in finance, materials science or diffusion. In this paper, an application of a well known transformation technique, Differential Transform Method (DTM), to the area of fractional differential equation is employed for calculating Lyapunov exponents of fractional order systems. It is known that the Lyapunov exponents, first introduced by Oseledec, play a crucial role in characterizing the behaviour of dynamical systems. They can be used to analyze the sensitive dependence on initial conditions and the presence of chaotic attractors. The results reveal that the proposed method is very effective and simple and leads to accurate, approximately convergent solutions.

  6. Resolving the Tevatron Top Quark Forward-Backward Asymmetry Puzzle: Fully Differential Next-to-Next-to-Leading-Order Calculation.

    PubMed

    Czakon, Michal; Fiedler, Paul; Mitov, Alexander

    2015-07-31

    We determine the dominant missing standard model (SM) contribution to the top quark pair forward-backward asymmetry at the Tevatron. Contrary to past expectations, we find a large, around 27%, shift relative to the well-known value of the inclusive asymmetry in next-to-leading order QCD. Combining all known standard model corrections, we find that A(FB)(SM)=0.095±0.007. This value is in agreement with the latest DØ measurement [V. M. Abazov et al. (D0 Collaboration), Phys. Rev. D 90, 072011 (2014)] A(FB)(D∅)=0.106±0.03 and about 1.5σ below that of CDF [T. Aaltonen et al. (CDF Collaboration), Phys. Rev. D 87, 092002 (2013)] A(FB)(CDF)=0.164±0.047. Our result is derived from a fully differential calculation of the next-to-next-to leading order (NNLO) QCD corrections to inclusive top pair production at hadron colliders and includes-without any approximation-all partonic channels contributing to this process. This is the first complete fully differential calculation in NNLO QCD of a two-to-two scattering process with all colored partons.

  7. Numerical solution of sixth-order boundary-value problems using Legendre wavelet collocation method

    NASA Astrophysics Data System (ADS)

    Sohaib, Muhammad; Haq, Sirajul; Mukhtar, Safyan; Khan, Imad

    2018-03-01

    An efficient method is proposed to approximate sixth order boundary value problems. The proposed method is based on Legendre wavelet in which Legendre polynomial is used. The mechanism of the method is to use collocation points that converts the differential equation into a system of algebraic equations. For validation two test problems are discussed. The results obtained from proposed method are quite accurate, also close to exact solution, and other different methods. The proposed method is computationally more effective and leads to more accurate results as compared to other methods from literature.

  8. Computing general-relativistic effects from Newtonian N-body simulations: Frame dragging in the post-Friedmann approach

    NASA Astrophysics Data System (ADS)

    Bruni, Marco; Thomas, Daniel B.; Wands, David

    2014-02-01

    We present the first calculation of an intrinsically relativistic quantity, the leading-order correction to Newtonian theory, in fully nonlinear cosmological large-scale structure studies. Traditionally, nonlinear structure formation in standard ΛCDM cosmology is studied using N-body simulations, based on Newtonian gravitational dynamics on an expanding background. When one derives the Newtonian regime in a way that is a consistent approximation to the Einstein equations, the first relativistic correction to the usual Newtonian scalar potential is a gravitomagnetic vector potential, giving rise to frame dragging. At leading order, this vector potential does not affect the matter dynamics, thus it can be computed from Newtonian N-body simulations. We explain how we compute the vector potential from simulations in ΛCDM and examine its magnitude relative to the scalar potential, finding that the power spectrum of the vector potential is of the order 10-5 times the scalar power spectrum over the range of nonlinear scales we consider. On these scales the vector potential is up to two orders of magnitudes larger than the value predicted by second-order perturbation theory extrapolated to the same scales. We also discuss some possible observable effects and future developments.

  9. Diagrammatic Monte Carlo approach for diagrammatic extensions of dynamical mean-field theory: Convergence analysis of the dual fermion technique

    NASA Astrophysics Data System (ADS)

    Gukelberger, Jan; Kozik, Evgeny; Hafermann, Hartmut

    2017-07-01

    The dual fermion approach provides a formally exact prescription for calculating properties of a correlated electron system in terms of a diagrammatic expansion around dynamical mean-field theory (DMFT). Most practical implementations, however, neglect higher-order interaction vertices beyond two-particle scattering in the dual effective action and further truncate the diagrammatic expansion in the two-particle scattering vertex to a leading-order or ladder-type approximation. In this work, we compute the dual fermion expansion for the two-dimensional Hubbard model including all diagram topologies with two-particle interactions to high orders by means of a stochastic diagrammatic Monte Carlo algorithm. We benchmark the obtained self-energy against numerically exact diagrammatic determinant Monte Carlo simulations to systematically assess convergence of the dual fermion series and the validity of these approximations. We observe that, from high temperatures down to the vicinity of the DMFT Néel transition, the dual fermion series converges very quickly to the exact solution in the whole range of Hubbard interactions considered (4 ≤U /t ≤12 ), implying that contributions from higher-order vertices are small. As the temperature is lowered further, we observe slower series convergence, convergence to incorrect solutions, and ultimately divergence. This happens in a regime where magnetic correlations become significant. We find, however, that the self-consistent particle-hole ladder approximation yields reasonable and often even highly accurate results in this regime.

  10. The asymptotic spectra of banded Toeplitz and quasi-Toeplitz matrices

    NASA Technical Reports Server (NTRS)

    Beam, Richard M.; Warming, Robert F.

    1991-01-01

    Toeplitz matrices occur in many mathematical, as well as, scientific and engineering investigations. This paper considers the spectra of banded Toeplitz and quasi-Toeplitz matrices with emphasis on non-normal matrices of arbitrarily large order and relatively small bandwidth. These are the type of matrices that appear in the investigation of stability and convergence of difference approximations to partial differential equations. Quasi-Toeplitz matrices are the result of non-Dirichlet boundary conditions for the difference approximations. The eigenvalue problem for a banded Toeplitz or quasi-Toeplitz matrix of large order is, in general, analytically intractable and (for non-normal matrices) numerically unreliable. An asymptotic (matrix order approaches infinity) approach partitions the eigenvalue analysis of a quasi-Toeplitz matrix into two parts, namely the analysis for the boundary condition independent spectrum and the analysis for the boundary condition dependent spectrum. The boundary condition independent spectrum is the same as the pure Toeplitz matrix spectrum. Algorithms for computing both parts of the spectrum are presented. Examples are used to demonstrate the utility of the algorithms, to present some interesting spectra, and to point out some of the numerical difficulties encountered when conventional matrix eigenvalue routines are employed for non-normal matrices of large order. The analysis for the Toeplitz spectrum also leads to a diagonal similarity transformation that improves conventional numerical eigenvalue computations. Finally, the algorithm for the asymptotic spectrum is extended to the Toeplitz generalized eigenvalue problem which occurs, for example, in the stability of Pade type difference approximations to differential equations.

  11. Coupling of Coastal Wave Transformation and Computational Fluid Dynamics Models for Seakeeping Analysis

    DTIC Science & Technology

    2017-04-03

    setup in terms of temporal and spatial discretization . The second component was an extension of existing depth-integrated wave models to describe...equations (Abbott, 1976). Discretization schemes involve numerical dispersion and dissipation that distort the true character of the governing equations...represent a leading-order approximation of the Boussinesq-type equations. Tam and Webb (1993) proposed a wavenumber-based discretization scheme to preserve

  12. Thermal desorption of CO and H2 from degassed 304 and 347 stainless steel

    NASA Technical Reports Server (NTRS)

    Rezaie-Serej, S.; Outlaw, R. A.

    1994-01-01

    Thermal desorption spectroscopy (TDS), along with Auger electron spectroscopy, was used to study the desorption of H2 and CO from baked 304 and 347 stainless-steel samples exposed only to residual gases. Both 347 and 304 samples gave identical TDS spectra. The spectra for CO contained a sharp leading peak centered in the temperature range 410-440C and an exponentially increasing part for temperatures higher than 500C, with a small peak around 600C appearing as a shoulder. The leading peak followed a second-order desorption behavior with an activation energy of 28+/-2 kcal/mol, suggesting that the rate-limiting step for this peak is most likely a surface reaction that produces the CO molecules in the surface layer. The amount of desorbed CO corresponding to this peak was approximately 0.5X10(exp 14) molecules/cm(exp 2) . The exponentially rising part of the CO spectrum appeared to originate from a bulk diffusion process. The TDS spectrum for H2 consisted of a main peak centered also in the temperature range 410-440C, with two small peaks appearing as shoulders at approximately 500 and 650C. The main peak in this case also displayed a second-order behavior with an activation energy of 14+/-2 kcal/mol. The amount of desorbed H2, approximately 1.9X 10(exp 15) molecules/cm(exp 2) , appeared to be independent of the concentration of hydrogen in the bulk, indicating that the majority of the desorbed H2 originated from the surface layer.

  13. Complete Hamiltonian analysis of cosmological perturbations at all orders

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Nandi, Debottam; Shankaranarayanan, S., E-mail: debottam@iisertvm.ac.in, E-mail: shanki@iisertvm.ac.in

    2016-06-01

    In this work, we present a consistent Hamiltonian analysis of cosmological perturbations at all orders. To make the procedure transparent, we consider a simple model and resolve the 'gauge-fixing' issues and extend the analysis to scalar field models and show that our approach can be applied to any order of perturbation for any first order derivative fields. In the case of Galilean scalar fields, our procedure can extract constrained relations at all orders in perturbations leading to the fact that there is no extra degrees of freedom due to the presence of higher time derivatives of the field in themore » Lagrangian. We compare and contrast our approach to the Lagrangian approach (Chen et al. [2006]) for extracting higher order correlations and show that our approach is efficient and robust and can be applied to any model of gravity and matter fields without invoking slow-roll approximation.« less

  14. Seismic waves in heterogeneous material: subcell resolution of the discontinuous Galerkin method

    NASA Astrophysics Data System (ADS)

    Castro, Cristóbal E.; Käser, Martin; Brietzke, Gilbert B.

    2010-07-01

    We present an important extension of the arbitrary high-order discontinuous Galerkin (DG) finite-element method to model 2-D elastic wave propagation in highly heterogeneous material. In this new approach we include space-variable coefficients to describe smooth or discontinuous material variations inside each element using the same numerical approximation strategy as for the velocity-stress variables in the formulation of the elastic wave equation. The combination of the DG method with a time integration scheme based on the solution of arbitrary accuracy derivatives Riemann problems still provides an explicit, one-step scheme which achieves arbitrary high-order accuracy in space and time. Compared to previous formulations the new scheme contains two additional terms in the form of volume integrals. We show that the increasing computational cost per element can be overcompensated due to the improved material representation inside each element as coarser meshes can be used which reduces the total number of elements and therefore computational time to reach a desired error level. We confirm the accuracy of the proposed scheme performing convergence tests and several numerical experiments considering smooth and highly heterogeneous material. As the approximation of the velocity and stress variables in the wave equation and of the material properties in the model can be chosen independently, we investigate the influence of the polynomial material representation on the accuracy of the synthetic seismograms with respect to computational cost. Moreover, we study the behaviour of the new method on strong material discontinuities, in the case where the mesh is not aligned with such a material interface. In this case second-order linear material approximation seems to be the best choice, with higher-order intra-cell approximation leading to potential instable behaviour. For all test cases we validate our solution against the well-established standard fourth-order finite difference and spectral element method.

  15. Simultaneous calibration of ensemble river flow predictions over an entire range of lead times

    NASA Astrophysics Data System (ADS)

    Hemri, S.; Fundel, F.; Zappa, M.

    2013-10-01

    Probabilistic estimates of future water levels and river discharge are usually simulated with hydrologic models using ensemble weather forecasts as main inputs. As hydrologic models are imperfect and the meteorological ensembles tend to be biased and underdispersed, the ensemble forecasts for river runoff typically are biased and underdispersed, too. Thus, in order to achieve both reliable and sharp predictions statistical postprocessing is required. In this work Bayesian model averaging (BMA) is applied to statistically postprocess ensemble runoff raw forecasts for a catchment in Switzerland, at lead times ranging from 1 to 240 h. The raw forecasts have been obtained using deterministic and ensemble forcing meteorological models with different forecast lead time ranges. First, BMA is applied based on mixtures of univariate normal distributions, subject to the assumption of independence between distinct lead times. Then, the independence assumption is relaxed in order to estimate multivariate runoff forecasts over the entire range of lead times simultaneously, based on a BMA version that uses multivariate normal distributions. Since river runoff is a highly skewed variable, Box-Cox transformations are applied in order to achieve approximate normality. Both univariate and multivariate BMA approaches are able to generate well calibrated probabilistic forecasts that are considerably sharper than climatological forecasts. Additionally, multivariate BMA provides a promising approach for incorporating temporal dependencies into the postprocessed forecasts. Its major advantage against univariate BMA is an increase in reliability when the forecast system is changing due to model availability.

  16. Communication: Vibrational and vibronic coherences in the two dimensional spectroscopy of coupled electron-nuclear motion.

    PubMed

    Albert, Julian; Falge, Mirjam; Gomez, Sandra; Sola, Ignacio R; Hildenbrand, Heiko; Engel, Volker

    2015-07-28

    We theoretically investigate the photon-echo spectroscopy of coupled electron-nuclear quantum dynamics. Two situations are treated. In the first case, the Born-Oppenheimer (adiabatic) approximation holds. It is then possible to interpret the two-dimensional (2D) spectra in terms of vibrational motion taking place in different electronic states. In particular, pure vibrational coherences which are related to oscillations in the time-dependent third-order polarization can be identified. This concept fails in the second case, where strong non-adiabatic coupling leads to the breakdown of the Born-Oppenheimer-approximation. Then, the 2D-spectra reveal a complicated vibronic structure and vibrational coherences cannot be disentangled from the electronic motion.

  17. Resistive-force theory for mesh-like superhydrophobic surfaces

    NASA Astrophysics Data System (ADS)

    Schnitzer, Ory; Yariv, Ehud

    2018-03-01

    A common realization of superhydrophobic surfaces makes use of a mesh-like geometry, where pockets of air are trapped in a periodic array of holes in a no-slip solid substrate. We consider the small-solid-fraction limit where the ribs of the mesh are narrow. In this limit, we obtain a simple leading-order approximation for the slip-length tensor of an arbitrary mesh geometry. This approximation scales as the solid-fraction logarithm, as anticipated by Ybert et al. [Phys. Fluids 19, 123601 (2007), 10.1063/1.2815730]; in the special case of a square mesh it agrees with the analytical results obtained by Davis and Lauga [Phys. Fluids 21, 113101 (2009), 10.1063/1.3250947].

  18. Communication: Vibrational and vibronic coherences in the two dimensional spectroscopy of coupled electron-nuclear motion

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Albert, Julian; Falge, Mirjam; Hildenbrand, Heiko

    2015-07-28

    We theoretically investigate the photon-echo spectroscopy of coupled electron-nuclear quantum dynamics. Two situations are treated. In the first case, the Born-Oppenheimer (adiabatic) approximation holds. It is then possible to interpret the two-dimensional (2D) spectra in terms of vibrational motion taking place in different electronic states. In particular, pure vibrational coherences which are related to oscillations in the time-dependent third-order polarization can be identified. This concept fails in the second case, where strong non-adiabatic coupling leads to the breakdown of the Born-Oppenheimer-approximation. Then, the 2D-spectra reveal a complicated vibronic structure and vibrational coherences cannot be disentangled from the electronic motion.

  19. The isotropic-nematic phase transition of tangent hard-sphere chain fluids—Pure components

    NASA Astrophysics Data System (ADS)

    van Westen, Thijs; Oyarzún, Bernardo; Vlugt, Thijs J. H.; Gross, Joachim

    2013-07-01

    An extension of Onsager's second virial theory is developed to describe the isotropic-nematic phase transition of tangent hard-sphere chain fluids. Flexibility is introduced by the rod-coil model. The effect of chain-flexibility on the second virial coefficient is described using an accurate, analytical approximation for the orientation-dependent pair-excluded volume. The use of this approximation allows for an analytical treatment of intramolecular flexibility by using a single pure-component parameter. Two approaches to approximate the effect of the higher virial coefficients are considered, i.e., the Vega-Lago rescaling and Scaled Particle Theory (SPT). The Onsager trial function is employed to describe the orientational distribution function. Theoretical predictions for the equation of state and orientational order parameter are tested against the results from Monte Carlo (MC) simulations. For linear chains of length 9 and longer, theoretical results are in excellent agreement with MC data. For smaller chain lengths, small errors introduced by the approximation of the higher virial coefficients become apparent, leading to a small under- and overestimation of the pressure and density difference at the phase transition, respectively. For rod-coil fluids of reasonable rigidity, a quantitative comparison between theory and MC simulations is obtained. For more flexible chains, however, both the Vega-Lago rescaling and SPT lead to a small underestimation of the location of the phase transition.

  20. Fourth generation CP violation effects on B-->Kpi, phiK, and rhoK in next-to-leading-order perturbative QCD.

    PubMed

    Hou, Wei-Shu; Li, Hsiang-nan; Mishima, Satoshi; Nagashima, Makiko

    2007-03-30

    We study the effect from a sequential fourth generation quark on penguin-dominated two-body nonleptonic B meson decays in the next-to-leading order perturbative QCD formalism. With an enhancement of the color-suppressed tree amplitude and possibility of a new CP phase in the electroweak penguin amplitude, we can account better for A(CP)(B(0)-->K+ pi-)-A(CP)(B+-->K+ pi0). Taking |V(t's)V(t'b)| approximately 0.02 with a phase just below 90 degrees, which is consistent with the b-->sl+ l- rate and the B(s) mixing parameter Deltam(B)(s), we find a downward shift in the mixing-induced CP asymmetries of B(0)-->K(S)(pi 0) and phi(K)(S). The predicted behavior for B(0)-->rho(0)(K)(S) is opposite.

  1. Λ N → NN EFT potentials and hypertriton non-mesonic weak decay

    NASA Astrophysics Data System (ADS)

    Pérez-Obiol, Axel; Entem, David R.; Nogga, Andreas

    2018-05-01

    The potential for the Λ N → NN weak transition, the main responsible for the non-mesonic weak decay of hypernuclei, has been developed within the framework of effective field theory (EFT) up to next-to-leading order (NLO). The leading order (LO) and NLO contributions have been calculated in both momentum and coordinate space, and have been organised into the different operators which mediate the N → NN transition. We compare the ranges of the one-meson and two-pion exchanges for each operator. The non-mesonic weak decay of the hypertriton has been computed within the plane-wave approximation using the LO weak potential and modern strong EFT NN potentials. Formally, two methods to calculate the final state interactions among the decay products are presented. We briefly comment on the calculation of the {}{{Λ }}{}3H{\\to }3 He+{π }- mesonic weak decay.

  2. Convergence of the chiral expansion in two-flavor lattice QCD.

    PubMed

    Noaki, J; Aoki, S; Chiu, T W; Fukaya, H; Hashimoto, S; Hsieh, T H; Kaneko, T; Matsufuru, H; Onogi, T; Shintani, E; Yamada, N

    2008-11-14

    We test the convergence property of the chiral perturbation theory using a lattice QCD calculation of pion mass and decay constant with two dynamical quark flavors. The lattice calculation is performed using the overlap fermion formulation, which realizes exact chiral symmetry at finite lattice spacing. By comparing various expansion prescriptions, we find that the chiral expansion is well saturated at the next-to-leading order for pions lighter than approximately 450 MeV. Better convergence behavior is found, in particular, for a resummed expansion parameter xi, with which the lattice data in the pion mass region 290-750 MeV can be fitted well with the next-to-next-to-leading order formulas. We obtain the results in two-flavor QCD for the low energy constants l[over ]_{3} and l[over ]_{4} as well as the pion decay constant, the chiral condensate, and the average up and down quark mass.

  3. One-loop supergravity on AdS 4 × S 7/Z k and comparison with ABJM theory

    DOE PAGES

    Liu, James T.; Zhao, Wenli

    2016-11-18

    The large-N limit of ABJM theory is holographically dual to M-theory on AdS 4 × S 7/Z k. The 3-sphere partition function has been obtained via localization, and its leading behavior F ABJM (0) ~ k 1/2N 3/2 is exactly reproduced in the dual theory by tree-level supergravity. In this paper, we extend this comparison to the sub-leading O(N 0) order by computing the one-loop supergravity free energy as a function of k and comparing it with the ABJM result. Curiously, we find that the expressions do not match, with F SUGRA (1)~k 6, while F ABJM (1)~ k 2.more » Finally, this suggests that the low-energy approximation Z M-theory = Z SUGRA breaks down at one-loop order.« less

  4. Parton distribution functions with QED corrections in the valon model

    NASA Astrophysics Data System (ADS)

    Mottaghizadeh, Marzieh; Taghavi Shahri, Fatemeh; Eslami, Parvin

    2017-10-01

    The parton distribution functions (PDFs) with QED corrections are obtained by solving the QCD ⊗QED DGLAP evolution equations in the framework of the "valon" model at the next-to-leading-order QCD and the leading-order QED approximations. Our results for the PDFs with QED corrections in this phenomenological model are in good agreement with the newly related CT14QED global fits code [Phys. Rev. D 93, 114015 (2016), 10.1103/PhysRevD.93.114015] and APFEL (NNPDF2.3QED) program [Comput. Phys. Commun. 185, 1647 (2014), 10.1016/j.cpc.2014.03.007] in a wide range of x =[10-5,1 ] and Q2=[0.283 ,108] GeV2 . The model calculations agree rather well with those codes. In the latter, we proposed a new method for studying the symmetry breaking of the sea quark distribution functions inside the proton.

  5. Geochemistry of manganese, iron, uranium, lead-210 and major ions in the Susquehanna River

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Lewis, D.M.

    1976-01-01

    The change in water composition accompanying a change in discharge of large streams and the Susquehanna River results from the change in the proportions of the total flow composed of type waters of constant composition. This change in the flow proportions is due to the different hydrologic responses to precipitation inputs of basins underlain by different single rock types. The in-river precipitation of mine-drainage-injected Mn and Fe was studied at a pH of approximately 7. For Mn the removal from solution appears to be first order. The rate constant is 10/sup 3/ times greater than the extrapolated autocatalytic rate constantmore » of previous laboratory experiments. The study of the removal of Fe from solution yields a first order rate constant consistent with previous laboratory experiments. Lead-210 was used as a natural tracer to study the fate of trace metals.« less

  6. Top down electroweak dipole operators

    NASA Astrophysics Data System (ADS)

    Fuyuto, Kaori; Ramsey-Musolf, Michael

    2018-06-01

    We derive present constraints on, and prospective sensitivity to, the electric dipole moment (EDM) of the top quark (dt) implied by searches for the EDMs of the electron and nucleons. Above the electroweak scale v, the dt arises from two gauge invariant operators generated at a scale Λ ≫ v that also mix with the light fermion EDMs under renormalization group evolution at two-loop order. Bounds on the EDMs of first generation fermion systems thus imply bounds on |dt |. Working in the leading log-squared approximation, we find that the present upper bound on |dt | is 10-19 e cm for Λ = 1 TeV, except in regions of finely tuned cancellations that allow for |dt | to be up to fifty times larger. Future de and dn probes may yield an order of magnitude increase in dt sensitivity, while inclusion of a prospective proton EDM search may lead to an additional increase in reach.

  7. A finite element method with overlapping meshes for free-boundary axisymmetric plasma equilibria in realistic geometries

    NASA Astrophysics Data System (ADS)

    Heumann, Holger; Rapetti, Francesca

    2017-04-01

    Existing finite element implementations for the computation of free-boundary axisymmetric plasma equilibria approximate the unknown poloidal flux function by standard lowest order continuous finite elements with discontinuous gradients. As a consequence, the location of critical points of the poloidal flux, that are of paramount importance in tokamak engineering, is constrained to nodes of the mesh leading to undesired jumps in transient problems. Moreover, recent numerical results for the self-consistent coupling of equilibrium with resistive diffusion and transport suggest the necessity of higher regularity when approximating the flux map. In this work we propose a mortar element method that employs two overlapping meshes. One mesh with Cartesian quadrilaterals covers the vacuum chamber domain accessible by the plasma and one mesh with triangles discretizes the region outside. The two meshes overlap in a narrow region. This approach gives the flexibility to achieve easily and at low cost higher order regularity for the approximation of the flux function in the domain covered by the plasma, while preserving accurate meshing of the geometric details outside this region. The continuity of the numerical solution in the region of overlap is weakly enforced by a mortar-like mapping.

  8. keV-Scale sterile neutrino sensitivity estimation with time-of-flight spectroscopy in KATRIN using self-consistent approximate Monte Carlo

    NASA Astrophysics Data System (ADS)

    Steinbrink, Nicholas M. N.; Behrens, Jan D.; Mertens, Susanne; Ranitzsch, Philipp C.-O.; Weinheimer, Christian

    2018-03-01

    We investigate the sensitivity of the Karlsruhe Tritium Neutrino Experiment (KATRIN) to keV-scale sterile neutrinos, which are promising dark matter candidates. Since the active-sterile mixing would lead to a second component in the tritium β-spectrum with a weak relative intensity of order sin ^2θ ≲ 10^{-6}, additional experimental strategies are required to extract this small signature and to eliminate systematics. A possible strategy is to run the experiment in an alternative time-of-flight (TOF) mode, yielding differential TOF spectra in contrast to the integrating standard mode. In order to estimate the sensitivity from a reduced sample size, a new analysis method, called self-consistent approximate Monte Carlo (SCAMC), has been developed. The simulations show that an ideal TOF mode would be able to achieve a statistical sensitivity of sin ^2θ ˜ 5 × 10^{-9} at one σ , improving the standard mode by approximately a factor two. This relative benefit grows significantly if additional exemplary systematics are considered. A possible implementation of the TOF mode with existing hardware, called gated filtering, is investigated, which, however, comes at the price of a reduced average signal rate.

  9. Basic features of the pion valence-quark distribution function

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Chang, Lei; Mezrag, Cédric; Moutarde, Hervé

    2014-10-07

    The impulse-approximation expression used hitherto to define the pion's valence-quark distribution function is flawed because it omits contributions from the gluons which bind quarks into the pion. A corrected leading-order expression produces the model-independent result that quarks dressed via the rainbow–ladder truncation, or any practical analogue, carry all the pion's light-front momentum at a characteristic hadronic scale. Corrections to the leading contribution may be divided into two classes, responsible for shifting dressed-quark momentum into glue and sea-quarks. Working with available empirical information, we use an algebraic model to express the principal impact of both classes of corrections. This enables amore » realistic comparison with experiment that allows us to highlight the basic features of the pion's measurable valence-quark distribution, q π(x); namely, at a characteristic hadronic scale, q π(x)~(1-x) 2 for x≳0.85; and the valence-quarks carry approximately two-thirds of the pion's light-front momentum.« less

  10. Identification and feedback control in structures with piezoceramic actuators

    NASA Technical Reports Server (NTRS)

    Banks, H. T.; Ito, K.; Wang, Y.

    1992-01-01

    In this lecture we give fundamental well-posedness results for a variational formulation of a class of damped second order partial differential equations with unbounded input or control coefficients. Included as special cases in this class are structures with piezoceramic actuators. We consider approximation techniques leading to computational methods in the context of both parameter estimation and feedback control problems for these systems. Rigorous convergence results for parameter estimates and feedback gains are discussed.

  11. Testing trivializing maps in the Hybrid Monte Carlo algorithm

    PubMed Central

    Engel, Georg P.; Schaefer, Stefan

    2011-01-01

    We test a recent proposal to use approximate trivializing maps in a field theory to speed up Hybrid Monte Carlo simulations. Simulating the CPN−1 model, we find a small improvement with the leading order transformation, which is however compensated by the additional computational overhead. The scaling of the algorithm towards the continuum is not changed. In particular, the effect of the topological modes on the autocorrelation times is studied. PMID:21969733

  12. Effective scattering coefficient of the cerebral spinal fluid in adult head models for diffuse optical imaging

    NASA Astrophysics Data System (ADS)

    Custo, Anna; Wells, William M., III; Barnett, Alex H.; Hillman, Elizabeth M. C.; Boas, David A.

    2006-07-01

    An efficient computation of the time-dependent forward solution for photon transport in a head model is a key capability for performing accurate inversion for functional diffuse optical imaging of the brain. The diffusion approximation to photon transport is much faster to simulate than the physically correct radiative transport equation (RTE); however, it is commonly assumed that scattering lengths must be much smaller than all system dimensions and all absorption lengths for the approximation to be accurate. Neither of these conditions is satisfied in the cerebrospinal fluid (CSF). Since line-of-sight distances in the CSF are small, of the order of a few millimeters, we explore the idea that the CSF scattering coefficient may be modeled by any value from zero up to the order of the typical inverse line-of-sight distance, or approximately 0.3 mm-1, without significantly altering the calculated detector signals or the partial path lengths relevant for functional measurements. We demonstrate this in detail by using a Monte Carlo simulation of the RTE in a three-dimensional head model based on clinical magnetic resonance imaging data, with realistic optode geometries. Our findings lead us to expect that the diffusion approximation will be valid even in the presence of the CSF, with consequences for faster solution of the inverse problem.

  13. Oscillator strengths, first-order properties, and nuclear gradients for local ADC(2).

    PubMed

    Schütz, Martin

    2015-06-07

    We describe theory and implementation of oscillator strengths, orbital-relaxed first-order properties, and nuclear gradients for the local algebraic diagrammatic construction scheme through second order. The formalism is derived via time-dependent linear response theory based on a second-order unitary coupled cluster model. The implementation presented here is a modification of our previously developed algorithms for Laplace transform based local time-dependent coupled cluster linear response (CC2LR); the local approximations thus are state specific and adaptive. The symmetry of the Jacobian leads to considerable simplifications relative to the local CC2LR method; as a result, a gradient evaluation is about four times less expensive. Test calculations show that in geometry optimizations, usually very similar geometries are obtained as with the local CC2LR method (provided that a second-order method is applicable). As an exemplary application, we performed geometry optimizations on the low-lying singlet states of chlorophyllide a.

  14. Anomalous Price Impact and the Critical Nature of Liquidity in Financial Markets

    NASA Astrophysics Data System (ADS)

    Tóth, B.; Lempérière, Y.; Deremble, C.; de Lataillade, J.; Kockelkoren, J.; Bouchaud, J.-P.

    2011-10-01

    We propose a dynamical theory of market liquidity that predicts that the average supply/demand profile is V shaped and vanishes around the current price. This result is generic, and only relies on mild assumptions about the order flow and on the fact that prices are, to a first approximation, diffusive. This naturally accounts for two striking stylized facts: First, large metaorders have to be fragmented in order to be digested by the liquidity funnel, which leads to a long memory in the sign of the order flow. Second, the anomalously small local liquidity induces a breakdown of the linear response and a diverging impact of small orders, explaining the “square-root” impact law, for which we provide additional empirical support. Finally, we test our arguments quantitatively using a numerical model of order flow based on the same minimal ingredients.

  15. Enriched reproducing kernel particle method for fractional advection-diffusion equation

    NASA Astrophysics Data System (ADS)

    Ying, Yuping; Lian, Yanping; Tang, Shaoqiang; Liu, Wing Kam

    2018-06-01

    The reproducing kernel particle method (RKPM) has been efficiently applied to problems with large deformations, high gradients and high modal density. In this paper, it is extended to solve a nonlocal problem modeled by a fractional advection-diffusion equation (FADE), which exhibits a boundary layer with low regularity. We formulate this method on a moving least-square approach. Via the enrichment of fractional-order power functions to the traditional integer-order basis for RKPM, leading terms of the solution to the FADE can be exactly reproduced, which guarantees a good approximation to the boundary layer. Numerical tests are performed to verify the proposed approach.

  16. Resonance in the dynamics of chemical systems simulated by the implicit midpoint scheme

    NASA Astrophysics Data System (ADS)

    Mandziuk, Margaret; Schlick, Tamar

    1995-05-01

    The numerical behavior of the symplectic, implicit midpoint method with a wide range of integration timesteps is examined through an application to a diatomic molecule governed by a Morse potential. Our oscillator with a 12.6 fs period exhibits notable, integrator induced, timestep- ( Δt) dependent resonances and we predict approximate values of Δt where they will occur. The particular case of a third-order resonance ( Δt ≈ 7 fs here) leads to instability, and higher-order resonances ( n = 4, 5) to large energetic fluctuations and/or corrupted phase diagrams. Significantly, for Δt > 10 fs the energy errors remain bound.

  17. Effects of static equilibrium and higher-order nonlinearities on rotor blade stability in hover

    NASA Technical Reports Server (NTRS)

    Crespodasilva, Marcelo R. M.; Hodges, Dewey H.

    1988-01-01

    The equilibrium and stability of the coupled elastic lead/lag, flap, and torsion motion of a cantilever rotor blade in hover are addressed, and the influence of several higher-order terms in the equations of motion of the blade is determined for a range of values of collective pitch. The blade is assumed to be untwisted and to have uniform properties along its span. In addition, chordwise offsets between its elastic, tension, mass, and aerodynamic centers are assumed to be negligible for simplicity. The aerodynamic forces acting on the blade are modeled using a quasi-steady, strip-theory approximation.

  18. Charge-conjugation symmetric complete impulse approximation for the pion electromagnetic form factor in the covariant spectator theory

    DOE PAGES

    Biernat, Elmar P.; Gross, Franz; Peña, M. T.; ...

    2015-10-26

    The pion form factor is calculated in the framework of the charge-conjugation invariant covariant spectator theory. This formalism is established in Minkowski space, and the calculation is set up in momentum space. In a previous calculation we included only the leading pole coming from the spectator quark (referred to as the relativistic impulse approximation). In this study we also include the contributions from the poles of the quark which interacts with the photon and average over all poles in both the upper and lower half-planes in order to preserve charge conjugation invariance (referred to as the C-symmetric complete impulse approximation).more » We find that for small pion mass these contributions are significant at all values of the four-momentum transfer Q 2 but, surprisingly, do not alter the shape obtained from the spectator poles alone.« less

  19. Molecular Excitation Energies from Time-Dependent Density Functional Theory Employing Random-Phase Approximation Hessians with Exact Exchange.

    PubMed

    Heßelmann, Andreas

    2015-04-14

    Molecular excitation energies have been calculated with time-dependent density-functional theory (TDDFT) using random-phase approximation Hessians augmented with exact exchange contributions in various orders. It has been observed that this approach yields fairly accurate local valence excitations if combined with accurate asymptotically corrected exchange-correlation potentials used in the ground-state Kohn-Sham calculations. The inclusion of long-range particle-particle with hole-hole interactions in the kernel leads to errors of 0.14 eV only for the lowest excitations of a selection of three alkene, three carbonyl, and five azabenzene molecules, thus surpassing the accuracy of a number of common TDDFT and even some wave function correlation methods. In the case of long-range charge-transfer excitations, the method typically underestimates accurate reference excitation energies by 8% on average, which is better than with standard hybrid-GGA functionals but worse compared to range-separated functional approximations.

  20. Two-layer interfacial flows beyond the Boussinesq approximation: a Hamiltonian approach

    NASA Astrophysics Data System (ADS)

    Camassa, R.; Falqui, G.; Ortenzi, G.

    2017-02-01

    The theory of integrable systems of Hamiltonian PDEs and their near-integrable deformations is used to study evolution equations resulting from vertical-averages of the Euler system for two-layer stratified flows in an infinite two-dimensional channel. The Hamiltonian structure of the averaged equations is obtained directly from that of the Euler equations through the process of Hamiltonian reduction. Long-wave asymptotics together with the Boussinesq approximation of neglecting the fluids’ inertia is then applied to reduce the leading order vertically averaged equations to the shallow-water Airy system, albeit in a non-trivial way. The full non-Boussinesq system for the dispersionless limit can then be viewed as a deformation of this well known equation. In a perturbative study of this deformation, a family of approximate constants of the motion are explicitly constructed and used to find local solutions of the evolution equations by means of hodograph-like formulae.

  1. Analytical mass formula and nuclear surface properties in the ETF approximation. Part II: asymmetric nuclei

    NASA Astrophysics Data System (ADS)

    Aymard, François; Gulminelli, Francesca; Margueron, Jérôme

    2016-08-01

    We have recently addressed the problem of the determination of the nuclear surface energy for symmetric nuclei in the framework of the extended Thomas-Fermi (ETF) approximation using Skyrme functionals. We presently extend this formalism to the case of asymmetric nuclei and the question of the surface symmetry energy. We propose an approximate expression for the diffuseness and the surface energy. These quantities are analytically related to the parameters of the energy functional. In particular, the influence of the different equation of state parameters can be explicitly quantified. Detailed analyses of the different energy components (local/non-local, isoscalar/isovector, surface/curvature and higher order) are also performed. Our analytical solution of the ETF integral improves previous models and leads to a precision of better than 200 keV per nucleon in the determination of the nuclear binding energy for dripline nuclei.

  2. Cosmological perturbation theory and the spherical collapse model - II. Non-Gaussian initial conditions

    NASA Astrophysics Data System (ADS)

    Gaztanaga, Enrique; Fosalba, Pablo

    1998-12-01

    In Paper I of this series, we introduced the spherical collapse (SC) approximation in Lagrangian space as a way of estimating the cumulants xi_J of density fluctuations in cosmological perturbation theory (PT). Within this approximation, the dynamics is decoupled from the statistics of the initial conditions, so we are able to present here the cumulants for generic non-Gaussian initial conditions, which can be estimated to arbitrary order including the smoothing effects. The SC model turns out to recover the exact leading-order non-linear contributions up to terms involving non-local integrals of the J-point functions. We argue that for the hierarchical ratios S_J, these non-local terms are subdominant and tend to compensate each other. The resulting predictions show a non-trivial time evolution that can be used to discriminate between models of structure formation. We compare these analytic results with non-Gaussian N-body simulations, which turn out to be in very good agreement up to scales where sigma<~1.

  3. Two time scale output feedback regulation for ill-conditioned systems

    NASA Technical Reports Server (NTRS)

    Calise, A. J.; Moerder, D. D.

    1986-01-01

    Issues pertaining to the well-posedness of a two time scale approach to the output feedback regulator design problem are examined. An approximate quadratic performance index which reflects a two time scale decomposition of the system dynamics is developed. It is shown that, under mild assumptions, minimization of this cost leads to feedback gains providing a second-order approximation of optimal full system performance. A simplified approach to two time scale feedback design is also developed, in which gains are separately calculated to stabilize the slow and fast subsystem models. By exploiting the notion of combined control and observation spillover suppression, conditions are derived assuring that these gains will stabilize the full-order system. A sequential numerical algorithm is described which obtains output feedback gains minimizing a broad class of performance indices, including the standard LQ case. It is shown that the algorithm converges to a local minimum under nonrestrictive assumptions. This procedure is adapted to and demonstrated for the two time scale design formulations.

  4. Modeling the physisorption of graphene on metals

    NASA Astrophysics Data System (ADS)

    Tao, Jianmin; Tang, Hong; Patra, Abhirup; Bhattarai, Puskar; Perdew, John P.

    2018-04-01

    Many processes of technological and fundamental importance occur on surfaces. Adsorption is one of these phenomena that has received the most attention. However, it presents a great challenge to conventional density functional theory. Starting with the Lifshitz-Zaremba-Kohn second-order perturbation theory, here we develop a long-range van der Waals (vdW) correction for physisorption of graphene on metals. The model importantly includes quadrupole-surface interaction and screening effects. The results show that, when the vdW correction is combined with the Perdew-Burke-Enzerhof functional, it yields adsorption energies in good agreement with the random-phase approximation, significantly improving upon other vdW methods. We also find that, compared with the leading-order interaction, the higher-order quadrupole-surface correction accounts for about 25 % of the total vdW correction, suggesting the importance of the higher-order term.

  5. Correlation-driven charge order at the interface between a Mott and a band insulator.

    PubMed

    Pentcheva, Rossitza; Pickett, Warren E

    2007-07-06

    To study digital Mott insulator LaTiO3 and band insulator SrTiO3 interfaces, we apply correlated band theory within the local density approximation including a Hubbard U to (n, m) multilayers, 1

  6. Analytical study of spheroidal dust grains in plasma

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Zahed, H.; Mahmoodi, J.; Sobhanian, S.

    2006-05-15

    Using the modified spheroidal equations, the potential of a spheroidal conducting grain, floated in a plasma, is calculated. The electric field and capacitance for both prolate and oblate spheroidal grains are investigated. The solutions, obtained up to the second-order approximation, show that the plasma screening causes the equipotential surfaces around the grain to be more elongated or flattened than the potential spheroids of the Laplace equation. This leads to the variation of the plasma concentration around the grain.

  7. An alpha particle model for Carbon-12

    NASA Astrophysics Data System (ADS)

    Rawlinson, J. I.

    2018-07-01

    We introduce a new model for the Carbon-12 nucleus and compute its lowest energy levels. Our model is inspired by previous work on the rigid body approximation in the B = 12 sector of the Skyrme model. We go beyond this approximation and treat the nucleus as a deformable body, finding several new states. A restricted set of deformations is considered, leading to a configuration space C which has a graph-like structure. We use ideas from quantum graph theory in order to make sense of quantum mechanics on C even though it is not a manifold. This is a new approach to Skyrmion quantisation and the method presented in this paper could be applied to a variety of other problems.

  8. Reduced-Order Direct Numerical Simulation of Solute Transport in Porous Media

    NASA Astrophysics Data System (ADS)

    Mehmani, Yashar; Tchelepi, Hamdi

    2017-11-01

    Pore-scale models are an important tool for analyzing fluid dynamics in porous materials (e.g., rocks, soils, fuel cells). Current direct numerical simulation (DNS) techniques, while very accurate, are computationally prohibitive for sample sizes that are statistically representative of the porous structure. Reduced-order approaches such as pore-network models (PNM) aim to approximate the pore-space geometry and physics to remedy this problem. Predictions from current techniques, however, have not always been successful. This work focuses on single-phase transport of a passive solute under advection-dominated regimes and delineates the minimum set of approximations that consistently produce accurate PNM predictions. Novel network extraction (discretization) and particle simulation techniques are developed and compared to high-fidelity DNS simulations for a wide range of micromodel heterogeneities and a single sphere pack. Moreover, common modeling assumptions in the literature are analyzed and shown that they can lead to first-order errors under advection-dominated regimes. This work has implications for optimizing material design and operations in manufactured (electrodes) and natural (rocks) porous media pertaining to energy systems. This work was supported by the Stanford University Petroleum Research Institute for Reservoir Simulation (SUPRI-B).

  9. NLO evolution of color dipoles in N=4 SYM

    DOE PAGES

    Chirilli, Giovanni A.; Balitsky, Ian

    2009-07-04

    Here, high-energy behavior of amplitudes in a gauge theory can be reformulated in terms of the evolution of Wilson-line operators. In the leading logarithmic approximation it is given by the conformally invariant BK equation for the evolution of color dipoles. In QCD, the next-to-leading order BK equation has both conformal and non-conformal parts, the latter providing the running of the coupling constant. To separate the conformally invariant effects from the running-coupling effects, we calculate the NLO evolution of the color dipoles in the conformalmore » $${\\cal N}$$=4 SYM theory. We define the "composite dipole operator" with the rapidity cutoff preserving conformal invariance.« less

  10. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Broda, Jill Terese

    The neutron flux across the nuclear reactor core is of interest to reactor designers and others. The diffusion equation, an integro-differential equation in space and energy, is commonly used to determine the flux level. However, the solution of a simplified version of this equation when automated is very time consuming. Since the flux level changes with time, in general, this calculation must be made repeatedly. Therefore solution techniques that speed the calculation while maintaining accuracy are desirable. One factor that contributes to the solution time is the spatial flux shape approximation used. It is common practice to use the samemore » order flux shape approximation in each energy group even though this method may not be the most efficient. The one-dimensional, two-energy group diffusion equation was solved, for the node average flux and core k-effective, using two sets of spatial shape approximations for each of three reactor types. A fourth-order approximation in both energy groups forms the first set of approximations used. The second set used combines a second-order approximation with a fourth-order approximation in energy group two. Comparison of the results from the two approximation sets show that the use of a different order spatial flux shape approximation results in considerable loss in accuracy for the pressurized water reactor modeled. However, the loss in accuracy is small for the heavy water and graphite reactors modeled. The use of different order approximations in each energy group produces mixed results. Further investigation into the accuracy and computing time is required before any quantitative advantage of the use of the second-order approximation in energy group one and the fourth-order approximation in energy group two can be determined.« less

  11. Stokes waves revisited: Exact solutions in the asymptotic limit

    NASA Astrophysics Data System (ADS)

    Davies, Megan; Chattopadhyay, Amit K.

    2016-03-01

    The Stokes perturbative solution of the nonlinear (boundary value dependent) surface gravity wave problem is known to provide results of reasonable accuracy to engineers in estimating the phase speed and amplitudes of such nonlinear waves. The weakling in this structure though is the presence of aperiodic "secular variation" in the solution that does not agree with the known periodic propagation of surface waves. This has historically necessitated increasingly higher-ordered (perturbative) approximations in the representation of the velocity profile. The present article ameliorates this long-standing theoretical insufficiency by invoking a compact exact n -ordered solution in the asymptotic infinite depth limit, primarily based on a representation structured around the third-ordered perturbative solution, that leads to a seamless extension to higher-order (e.g., fifth-order) forms existing in the literature. The result from this study is expected to improve phenomenological engineering estimates, now that any desired higher-ordered expansion may be compacted within the same representation, but without any aperiodicity in the spectral pattern of the wave guides.

  12. Diagrammatic expansion for positive density-response spectra: Application to the electron gas

    NASA Astrophysics Data System (ADS)

    Uimonen, A.-M.; Stefanucci, G.; Pavlyukh, Y.; van Leeuwen, R.

    2015-03-01

    In a recent paper [Phys. Rev. B 90, 115134 (2014), 10.1103/PhysRevB.90.115134] we put forward a diagrammatic expansion for the self-energy which guarantees the positivity of the spectral function. In this work we extend the theory to the density-response function. We write the generic diagram for the density-response spectrum as the sum of "partitions." In a partition the original diagram is evaluated using time-ordered Green's functions on the left half of the diagram, antitime-ordered Green's functions on the right half of the diagram, and lesser or greater Green's function gluing the two halves. As there exists more than one way to cut a diagram in two halves, to every diagram corresponds more than one partition. We recognize that the most convenient diagrammatic objects for constructing a theory of positive spectra are the half-diagrams. Diagrammatic approximations obtained by summing the squares of half-diagrams do indeed correspond to a combination of partitions which, by construction, yield a positive spectrum. We develop the theory using bare Green's functions and subsequently extend it to dressed Green's functions. We further prove a connection between the positivity of the spectral function and the analytic properties of the polarizability. The general theory is illustrated with several examples and then applied to solve the long-standing problem of including vertex corrections without altering the positivity of the spectrum. In fact already the first-order vertex diagram, relevant to the study of gradient expansion, Friedel oscillations, etc., leads to spectra which are negative in certain frequency domain. We find that the simplest approximation to cure this deficiency is given by the sum of the zeroth-order bubble diagram, the first-order vertex diagram, and a partition of the second-order ladder diagram. We evaluate this approximation in the three-dimensional homogeneous electron gas and show the positivity of the spectrum for all frequencies and densities.

  13. Estimate of higher order ionospheric errors in GNSS positioning

    NASA Astrophysics Data System (ADS)

    Hoque, M. Mainul; Jakowski, N.

    2008-10-01

    Precise navigation and positioning using GPS/GLONASS/Galileo require the ionospheric propagation errors to be accurately determined and corrected for. Current dual-frequency method of ionospheric correction ignores higher order ionospheric errors such as the second and third order ionospheric terms in the refractive index formula and errors due to bending of the signal. The total electron content (TEC) is assumed to be same at two GPS frequencies. All these assumptions lead to erroneous estimations and corrections of the ionospheric errors. In this paper a rigorous treatment of these problems is presented. Different approximation formulas have been proposed to correct errors due to excess path length in addition to the free space path length, TEC difference at two GNSS frequencies, and third-order ionospheric term. The GPS dual-frequency residual range errors can be corrected within millimeter level accuracy using the proposed correction formulas.

  14. Airfoil Shape Optimization based on Surrogate Model

    NASA Astrophysics Data System (ADS)

    Mukesh, R.; Lingadurai, K.; Selvakumar, U.

    2018-02-01

    Engineering design problems always require enormous amount of real-time experiments and computational simulations in order to assess and ensure the design objectives of the problems subject to various constraints. In most of the cases, the computational resources and time required per simulation are large. In certain cases like sensitivity analysis, design optimisation etc where thousands and millions of simulations have to be carried out, it leads to have a life time of difficulty for designers. Nowadays approximation models, otherwise called as surrogate models (SM), are more widely employed in order to reduce the requirement of computational resources and time in analysing various engineering systems. Various approaches such as Kriging, neural networks, polynomials, Gaussian processes etc are used to construct the approximation models. The primary intention of this work is to employ the k-fold cross validation approach to study and evaluate the influence of various theoretical variogram models on the accuracy of the surrogate model construction. Ordinary Kriging and design of experiments (DOE) approaches are used to construct the SMs by approximating panel and viscous solution algorithms which are primarily used to solve the flow around airfoils and aircraft wings. The method of coupling the SMs with a suitable optimisation scheme to carryout an aerodynamic design optimisation process for airfoil shapes is also discussed.

  15. Low-rank separated representation surrogates of high-dimensional stochastic functions: Application in Bayesian inference

    NASA Astrophysics Data System (ADS)

    Validi, AbdoulAhad

    2014-03-01

    This study introduces a non-intrusive approach in the context of low-rank separated representation to construct a surrogate of high-dimensional stochastic functions, e.g., PDEs/ODEs, in order to decrease the computational cost of Markov Chain Monte Carlo simulations in Bayesian inference. The surrogate model is constructed via a regularized alternative least-square regression with Tikhonov regularization using a roughening matrix computing the gradient of the solution, in conjunction with a perturbation-based error indicator to detect optimal model complexities. The model approximates a vector of a continuous solution at discrete values of a physical variable. The required number of random realizations to achieve a successful approximation linearly depends on the function dimensionality. The computational cost of the model construction is quadratic in the number of random inputs, which potentially tackles the curse of dimensionality in high-dimensional stochastic functions. Furthermore, this vector-valued separated representation-based model, in comparison to the available scalar-valued case, leads to a significant reduction in the cost of approximation by an order of magnitude equal to the vector size. The performance of the method is studied through its application to three numerical examples including a 41-dimensional elliptic PDE and a 21-dimensional cavity flow.

  16. Radiative corrections to quantum sticking on graphene

    NASA Astrophysics Data System (ADS)

    Sengupta, Sanghita; Clougherty, Dennis P.

    2017-07-01

    We study the sticking rate of atomic hydrogen to suspended graphene using four different methods that include contributions from processes with multiphonon emission. We compare the numerical results of the sticking rate obtained by: (i) the loop expansion of the atom self-energy; (ii) the noncrossing approximation (NCA); (iii) the independent boson model approximation (IBMA); and (iv) a leading-order soft-phonon resummation method (SPR). The loop expansion reveals an infrared problem, analogous to the infamous infrared problem in QED. The two-loop contribution to the sticking rate gives a result that tends to diverge for large membranes. The latter three methods remedy this infrared problem and give results that are finite in the limit of an infinite membrane. We find that for micromembranes (sizes ranging 100 nm to 10 μ m ), the latter three methods give results that are in good agreement with each other and yield sticking rates that are mildly suppressed relative to the lowest-order golden rule rate. Lastly, we find that the SPR sticking rate decreases slowly to zero with increasing membrane size, while both the NCA and IBMA rates tend to a nonzero constant in this limit. Thus, approximations to the sticking rate can be sensitive to the effects of soft-phonon emission for large membranes.

  17. Efficient spectral-Galerkin algorithms for direct solution for second-order differential equations using Jacobi polynomials

    NASA Astrophysics Data System (ADS)

    Doha, E.; Bhrawy, A.

    2006-06-01

    It is well known that spectral methods (tau, Galerkin, collocation) have a condition number of ( is the number of retained modes of polynomial approximations). This paper presents some efficient spectral algorithms, which have a condition number of , based on the Jacobi?Galerkin methods of second-order elliptic equations in one and two space variables. The key to the efficiency of these algorithms is to construct appropriate base functions, which lead to systems with specially structured matrices that can be efficiently inverted. The complexities of the algorithms are a small multiple of operations for a -dimensional domain with unknowns, while the convergence rates of the algorithms are exponentials with smooth solutions.

  18. Closure Report for Corrective Action Unit 166: Storage Yards and Contaminated Materials, Nevada Test Site, Nevada

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    NSTec Environmental Restoration

    2009-08-01

    Corrective Action Unit (CAU) 166 is identified in the Federal Facility Agreement and Consent Order (FFACO) as 'Storage Yards and Contaminated Materials' and consists of the following seven Corrective Action Sites (CASs), located in Areas 2, 3, 5, and 18 of the Nevada Test Site: CAS 02-42-01, Condo Release Storage Yd - North; CAS 02-42-02, Condo Release Storage Yd - South; CAS 02-99-10, D-38 Storage Area; CAS 03-42-01, Conditional Release Storage Yard; CAS 05-19-02, Contaminated Soil and Drum; CAS 18-01-01, Aboveground Storage Tank; and CAS 18-99-03, Wax Piles/Oil Stain. Closure activities were conducted from March to July 2009 according tomore » the FF ACO (1996, as amended February 2008) and the Corrective Action Plan for CAU 166 (U.S. Department of Energy, National Nuclear Security Administration Nevada Site Office, 2007b). The corrective action alternatives included No Further Action and Clean Closure. Closure activities are summarized. CAU 166, Storage Yards and Contaminated Materials, consists of seven CASs in Areas 2, 3, 5, and 18 of the NTS. The closure alternatives included No Further Action and Clean Closure. This CR provides a summary of completed closure activities, documentation of waste disposal, and confirmation that remediation goals were met. The following site closure activities were performed at CAU 166 as documented in this CR: (1) At CAS 02-99-10, D-38 Storage Area, approximately 40 gal of lead shot were removed and are currently pending treatment and disposal as MW, and approximately 50 small pieces of DU were removed and disposed as LLW. (2) At CAS 03-42-01, Conditional Release Storage Yard, approximately 7.5 yd{sup 3} of soil impacted with lead and Am-241 were removed and disposed as LLW. As a BMP, approximately 22 ft{sup 3} of asbestos tile were removed from a portable building and disposed as ALLW, approximately 55 gal of oil were drained from accumulators and are currently pending disposal as HW, the portable building was removed and disposed as LLW, and accumulators, gas cylinders, and associated debris were removed and are currently pending treatment and disposal as MW. (3) At CAS 05-19-02, Contaminated Soil and Drum, as a BMP, an empty drum was removed and disposed as sanitary waste. (4) At CAS 18-01-01, Aboveground Storage Tank, approximately 165 gal of lead-impacted liquid were removed and are currently pending disposal as HW, and approximately 10 gal of lead shot and 6 yd{sup 3} of wax embedded with lead shot were removed and are currently pending treatment and disposal as MW. As a BMP, approximately 0.5 yd{sup 3} of wax were removed and disposed as hydrocarbon waste, approximately 55 gal of liquid were removed and disposed as sanitary waste, and two metal containers were grouted in place. (5) At CAS 18-99-03, Wax Piles/Oil Stain, no further action was required; however, as a BMP, approximately l.5 yd{sup 3} of wax were removed and disposed as hydrocarbon waste, and one metal container was grouted in place.« less

  19. Positivity-preserving cell-centered Lagrangian schemes for multi-material compressible flows: From first-order to high-orders. Part I: The one-dimensional case

    NASA Astrophysics Data System (ADS)

    Vilar, François; Shu, Chi-Wang; Maire, Pierre-Henri

    2016-05-01

    One of the main issues in the field of numerical schemes is to ally robustness with accuracy. Considering gas dynamics, numerical approximations may generate negative density or pressure, which may lead to nonlinear instability and crash of the code. This phenomenon is even more critical using a Lagrangian formalism, the grid moving and being deformed during the calculation. Furthermore, most of the problems studied in this framework contain very intense rarefaction and shock waves. In this paper, the admissibility of numerical solutions obtained by high-order finite-volume-scheme-based methods, such as the discontinuous Galerkin (DG) method, the essentially non-oscillatory (ENO) and the weighted ENO (WENO) finite volume schemes, is addressed in the one-dimensional Lagrangian gas dynamics framework. After briefly recalling how to derive Lagrangian forms of the 1D gas dynamics system of equations, a discussion on positivity-preserving approximate Riemann solvers, ensuring first-order finite volume schemes to be positive, is then given. This study is conducted for both ideal gas and non-ideal gas equations of state (EOS), such as the Jones-Wilkins-Lee (JWL) EOS or the Mie-Grüneisen (MG) EOS, and relies on two different techniques: either a particular definition of the local approximation of the acoustic impedances arising from the approximate Riemann solver, or an additional time step constraint relative to the cell volume variation. Then, making use of the work presented in [89,90,22], this positivity study is extended to high-orders of accuracy, where new time step constraints are obtained, and proper limitation is required. Through this new procedure, scheme robustness is highly improved and hence new problems can be tackled. Numerical results are provided to demonstrate the effectiveness of these methods. This paper is the first part of a series of two. The whole analysis presented here is extended to the two-dimensional case in [85], and proves to fit a wide range of numerical schemes in the literature, such as those presented in [19,64,15,82,84].

  20. Influences of the coordinate dependent noncommutative space on charged and spin currents

    NASA Astrophysics Data System (ADS)

    Ren, Ya-Jie; Ma, Kai

    2018-06-01

    We study the charged and spin currents on a coordinate dependent noncommutative space. Starting from the noncommutative extended relativistic equation of motion, the nonrelativistic approximation is obtained by using the Foldy-Wouthuysen transformation, and then the charged and spin currents are derived by using the extended Drude model. We find that the charged current is twisted by modifying the off-diagonal elements of the Hall conductivity, however, the spin current is not affected up to leading order of the noncommutative parameter.

  1. Geometric factor and influence of sensors in the establishment of a resistivity-moisture relation in soil samples

    NASA Astrophysics Data System (ADS)

    López-Sánchez, M.; Mansilla-Plaza, L.; Sánchez-de-laOrden, M.

    2017-10-01

    Prior to field scale research, soil samples are analysed on a laboratory scale for electrical resistivity calibrations. Currently, there are a variety of field instruments to estimate the water content in soils using different physical phenomena. These instruments can be used to develop moisture-resistivity relationships on the same soil samples. This assures that measurements are performed on the same material and under the same conditions (e.g., humidity and temperature). A geometric factor is applied to the location of electrodes, in order to calculate the apparent electrical resistivity of the laboratory test cells. This geometric factor can be determined in three different ways: by means of the use of an analytical approximation, laboratory trials (experimental approximation), or by the analysis of a numerical model. The first case, the analytical approximation, is not appropriate for complex cells or arrays. And both, the experimental and numerical approximation can lead to inaccurate results. Therefore, we propose a novel approach to obtain a compromise solution between both techniques, providing a more precise determination of the geometrical factor.

  2. Design of the stabilizing control of the orbital motion in the vicinity of the collinear libration point L1 using the analytical representation of the invariant manifold

    NASA Astrophysics Data System (ADS)

    Maliavkin, G. P.; Shmyrov, A. S.; Shmyrov, V. A.

    2018-05-01

    Vicinities of collinear libration points of the Sun-Earth system are currently quite attractive for the space navigation. Today, various projects on placing of spacecrafts observing the Sun in the L1 libration point and telescopes in L2 have been implemented (e.g. spacecrafts "WIND", "SOHO", "Herschel", "Planck"). Collinear libration points being unstable leads to the problem of stabilization of a spacecraft's motion. Laws of stabilizing motion control in vicinity of L1 point can be constructed using the analytical representation of a stable invariant manifold. Efficiency of these control laws depends on the precision of the representation. Within the model of Hill's approximation of the circular restricted three-body problem in the rotating geocentric coordinate system one can obtain the analytical representation of an invariant manifold filled with bounded trajectories in a form of series in terms of powers of the phase variables. Approximate representations of the orders from the first to the fourth inclusive can be used to construct four laws of stabilizing feedback motion control under which trajectories approach the manifold. By virtue of numerical simulation the comparison can be made: how the precision of the representation of the invariant manifold influences the efficiency of the control, expressed by energy consumptions (characteristic velocity). It shows that using approximations of higher orders in constructing the control laws can significantly reduce the energy consumptions on implementing the control compared to the linear approximation.

  3. Numerical simulations of the convective flame in white dwarfs

    NASA Technical Reports Server (NTRS)

    Livne, Eli

    1993-01-01

    A first step toward better understanding of the mechanism driving convective flames in exploding white dwarfs is presented. The propagation of the convective flame is examined using a two-dimensional implicit hydrodynamical code. The large scales of the instability are captured by the grid while the scales that are smaller than the grid resolution are approximated by a mixing-length approximation. It is found that largescale perturbations (of order of the pressure scale height) do grow significantly during the expansion, leading to a very nonspherical burning front. The combustion rate is strongly enhanced (compared to the unperturbed case) during the first second, but later the expansion of the star suppresses the flame speed, leading to only partial incineration of the nuclear fuel. Our results imply that large-scale perturbations by themselves are not enough to explain the mechanism by which convective flames are driven, and a study of the whole spectrum of relevant perturbations is needed. The implications of these preliminary results on future simulations, in the context of current models for Type Ia supernovae, are discussed.

  4. A note on anomalous band-gap variations in semiconductors with temperature

    NASA Astrophysics Data System (ADS)

    Chakraborty, P. K.; Mondal, B. N.

    2018-03-01

    An attempt is made to theoretically study the band-gap variations (ΔEg) in semiconductors with temperature following the works, did by Fan and O'Donnell et al. based on thermodynamic functions. The semiconductor band-gap reflects the bonding energy. An increase in temperature changes the chemical bondings, and electrons are promoted from valence band to conduction band. In their analyses, they made several approximations with respect to temperature and other fitting parameters leading to real values of band-gap variations with linear temperature dependences. In the present communication, we have tried to re-analyse the works, specially did by Fan, and derived an analytical model for ΔEg(T). Because, it was based on the second-order perturbation technique of thermodynamic functions. Our analyses are made without any approximations with respect to temperatures and other fitting parameters mentioned in the text, leading to a complex functions followed by an oscillating nature of the variations of ΔEg. In support of the existence of the oscillating energy band-gap variations with temperature in a semiconductor, possible physical explanations are provided to justify the experimental observation for various materials.

  5. Decoherence and lead-induced interdot coupling in nonequilibrium electron transport through interacting quantum dots: A hierarchical quantum master equation approach

    NASA Astrophysics Data System (ADS)

    Härtle, R.; Cohen, G.; Reichman, D. R.; Millis, A. J.

    2013-12-01

    The interplay between interference effects and electron-electron interactions in electron transport through an interacting double quantum dot system is investigated using a hierarchical quantum master equation approach which becomes exact if carried to infinite order and converges well if the temperature is not too low. Decoherence due to electron-electron interactions is found to give rise to pronounced negative differential resistance, enhanced broadening of structures in current-voltage characteristics, and an inversion of the electronic population. Dependence on gate voltage is shown to be a useful method of distinguishing decoherence-induced phenomena from effects induced by other mechanisms such as the presence of a blocking state. Comparison of results obtained by the hierarchical quantum master equation approach to those obtained from the Born-Markov approximation to the Nakajima-Zwanzig equation and from the noncrossing approximation to the nonequilibrium Green's function reveals the importance of an interdot coupling that originates from the energy dependence of the conduction bands in the leads and the need for a systematic perturbative expansion.

  6. NLO Higgs+jet at Large Transverse Momenta Including Top Quark Mass Effects

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Neumann, Tobias

    We present a next-to-leading order calculation of H+jet in gluon fusion including the effect of a finite top quark massmore » $$m_t$$ at large transverse momenta. Using the recently published two-loop amplitudes in the high energy expansion and our previous setup that includes finite $$m_t$$ effects in a low energy expansion, we are able to obtain $$m_t$$-finite results for transverse momenta below 225 GeV and above 500 GeV with negligible remaining top quark mass uncertainty. The only remaining region that has to rely on the common leading order rescaling approach is the threshold region $$\\sqrt{\\hat s}\\simeq 2m_t$$. We demonstrate that this rescaling provides an excellent approximation in the high $$p_T$$ region. Our calculation settles the issue of top quark mass effects at large transverse momenta. It is implemented in the parton level Monte Carlo code MCFM and is publicly available immediately in version 8.2.« less

  7. Transverse momentum dependent (TMD) parton distribution functions generated in the modified DGLAP formalism based on the valence-like distributions

    NASA Astrophysics Data System (ADS)

    Hosseinkhani, H.; Modarres, M.; Olanj, N.

    2017-07-01

    Transverse momentum dependent (TMD) parton distributions, also referred to as unintegrated parton distribution functions (UPDFs), are produced via the Kimber-Martin-Ryskin (KMR) prescription. The GJR08 set of parton distribution functions (PDFs) which are based on the valence-like distributions is used, at the leading order (LO) and the next-to-leading order (NLO) approximations, as inputs of the KMR formalism. The general and the relative behaviors of the generated TMD PDFs at LO and NLO and their ratios in a wide range of the transverse momentum values, i.e. kt2 = 10, 102, 104 and 108GeV2 are investigated. It is shown that the properties of the parent valence-like PDFs are imprinted on the daughter TMD PDFs. Imposing the angular ordering constraint (AOC) leads to the dynamical variable limits on the integrals which in turn increase the contributions from the lower scales at lower kt2. The results are compared with our previous studies based on the MSTW2008 input PDFs and it is shown that the present calculation gives flatter TMD PDFs. Finally, a comparison of longitudinal structure function (FL) is made by using the produced TMD PDFs and those that were generated through the MSTW2008-LO PDF from our previous work and the corresponding data from H1 and ZEUS collaborations and a reasonable agreement is found.

  8. Fully decoupled monolithic projection method for natural convection problems

    NASA Astrophysics Data System (ADS)

    Pan, Xiaomin; Kim, Kyoungyoun; Lee, Changhoon; Choi, Jung-Il

    2017-04-01

    To solve time-dependent natural convection problems, we propose a fully decoupled monolithic projection method. The proposed method applies the Crank-Nicolson scheme in time and the second-order central finite difference in space. To obtain a non-iterative monolithic method from the fully discretized nonlinear system, we first adopt linearizations of the nonlinear convection terms and the general buoyancy term with incurring second-order errors in time. Approximate block lower-upper decompositions, along with an approximate factorization technique, are additionally employed to a global linearly coupled system, which leads to several decoupled subsystems, i.e., a fully decoupled monolithic procedure. We establish global error estimates to verify the second-order temporal accuracy of the proposed method for velocity, pressure, and temperature in terms of a discrete l2-norm. Moreover, according to the energy evolution, the proposed method is proved to be stable if the time step is less than or equal to a constant. In addition, we provide numerical simulations of two-dimensional Rayleigh-Bénard convection and periodic forced flow. The results demonstrate that the proposed method significantly mitigates the time step limitation, reduces the computational cost because only one Poisson equation is required to be solved, and preserves the second-order temporal accuracy for velocity, pressure, and temperature. Finally, the proposed method reasonably predicts a three-dimensional Rayleigh-Bénard convection for different Rayleigh numbers.

  9. Quantum phase transition with dissipative frustration

    NASA Astrophysics Data System (ADS)

    Maile, D.; Andergassen, S.; Belzig, W.; Rastelli, G.

    2018-04-01

    We study the quantum phase transition of the one-dimensional phase model in the presence of dissipative frustration, provided by an interaction of the system with the environment through two noncommuting operators. Such a model can be realized in Josephson junction chains with shunt resistances and resistances between the chain and the ground. Using a self-consistent harmonic approximation, we determine the phase diagram at zero temperature which exhibits a quantum phase transition between an ordered phase, corresponding to the superconducting state, and a disordered phase, corresponding to the insulating state with localized superconducting charge. Interestingly, we find that the critical line separating the two phases has a nonmonotonic behavior as a function of the dissipative coupling strength. This result is a consequence of the frustration between (i) one dissipative coupling that quenches the quantum phase fluctuations favoring the ordered phase and (ii) one that quenches the quantum momentum (charge) fluctuations leading to a vanishing phase coherence. Moreover, within the self-consistent harmonic approximation, we analyze the dissipation induced crossover between a first and second order phase transition, showing that quantum frustration increases the range in which the phase transition is second order. The nonmonotonic behavior is reflected also in the purity of the system that quantifies the degree of correlation between the system and the environment, and in the logarithmic negativity as an entanglement measure that encodes the internal quantum correlations in the chain.

  10. Thermal blocking of preheating

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Lerner, Rose; Tranberg, Anders, E-mail: rose.lerner@desy.de, E-mail: anders.tranberg@uis.no

    2015-04-01

    The parametric resonance responsible for preheating after inflation will end when self-interactions of the resonating field and interactions of this field with secondary degrees of freedom become important. In many cases, the effect may be quantified in terms of an effective mass and the resulting shifting out of the spectrum of the strongest resonance band. In certain curvaton models, such thermal blocking can even occur before preheating has begun, delaying or even preventing the decay of the curvaton. We investigate numerically to what extent this thermal blocking is realised in a specific scenario, and whether the effective mass is wellmore » approximated by the perturbative leading order thermal mass. We find that the qualitative behaviour is well reproduced in this approximation, and that the end of preheating can be confidently estimated.« less

  11. Improving multilevel Monte Carlo for stochastic differential equations with application to the Langevin equation

    PubMed Central

    Müller, Eike H.; Scheichl, Rob; Shardlow, Tony

    2015-01-01

    This paper applies several well-known tricks from the numerical treatment of deterministic differential equations to improve the efficiency of the multilevel Monte Carlo (MLMC) method for stochastic differential equations (SDEs) and especially the Langevin equation. We use modified equations analysis as an alternative to strong-approximation theory for the integrator, and we apply this to introduce MLMC for Langevin-type equations with integrators based on operator splitting. We combine this with extrapolation and investigate the use of discrete random variables in place of the Gaussian increments, which is a well-known technique for the weak approximation of SDEs. We show that, for small-noise problems, discrete random variables can lead to an increase in efficiency of almost two orders of magnitude for practical levels of accuracy. PMID:27547075

  12. On the evolution of perturbations to solutions of the Kadomtsev-Petviashvilli equation using the Benney-Luke equation

    NASA Astrophysics Data System (ADS)

    Ablowitz, Mark J.; Curtis, Christopher W.

    2011-05-01

    The Benney-Luke equation, which arises as a long wave asymptotic approximation of water waves, contains the Kadomtsev-Petviashvilli (KP) equation as a leading-order maximal balanced approximation. The question analyzed is how the Benney-Luke equation modifies the so-called web solutions of the KP equation. It is found that the Benney-Luke equation introduces dispersive radiation which breaks each of the symmetric soliton-like humps well away from the interaction region of the KP web solution into a tail of multi-peaked oscillating profiles behind the main solitary hump. Computation indicates that the wave structure is modified near the center of the interaction region. Both analytical and numerical techniques are employed for working with non-periodic, non-decaying solutions on unbounded domains.

  13. Forward neutral pion production in p + p and d + Au collisions at square root sNN=200 GeV.

    PubMed

    Adams, J; Aggarwal, M M; Ahammed, Z; Amonett, J; Anderson, B D; Arkhipkin, D; Averichev, G S; Badyal, S K; Bai, Y; Balewski, J; Barannikova, O; Barnby, L S; Baudot, J; Bekele, S; Belaga, V V; Bellingeri-Laurikainen, A; Bellwied, R; Berger, J; Bezverkhny, B I; Bharadwaj, S; Bhasin, A; Bhati, A K; Bhatia, V S; Bichsel, H; Bielcik, J; Bielcikova, J; Billmeier, A; Bland, L C; Blyth, C O; Blyth, S-L; Bonner, B E; Botje, M; Boucham, A; Bouchet, J; Brandin, A V; Bravar, A; Bystersky, M; Cadman, R V; Cai, X Z; Caines, H; Sánchez, M Calderón de la Barca; Catu, O; Cebra, D; Chajecki, Z; Chaloupka, P; Chattopadhyay, S; Chen, H F; Chen, J H; Chen, Y; Cheng, J; Cherney, M; Chikanian, A; Choi, H A; Christie, W; Coffin, J P; Cormier, T M; Cosentino, M R; Cramer, J G; Crawford, H J; Das, D; Das, S; Daugherity, M; de Moura, M M; Dedovich, T G; Dephillips, M; Derevschikov, A A; Didenko, L; Dietel, T; Dogra, S M; Dong, W J; Dong, X; Draper, J E; Du, F; Dubey, A K; Dunin, V B; Dunlop, J C; Mazumdar, M R Dutta; Eckardt, V; Edwards, W R; Efimov, L G; Emelianov, V; Engelage, J; Eppley, G; Erazmus, B; Estienne, M; Fachini, P; Faivre, J; Fatemi, R; Fedorisin, J; Filimonov, K; Filip, P; Finch, E; Fine, V; Fisyak, Y; Fornazier, K S F; Fox, B D; Fu, J; Gagliardi, C A; Gaillard, L; Gans, J; Ganti, M S; Geurts, F; Ghazikhanian, V; Ghosh, P; Gonzalez, J E; Gorbunov, Y G; Gos, H; Grachov, O; Grebenyuk, O; Grosnick, D; Guertin, S M; Guo, Y; Gupta, A; Gupta, N; Gutierrez, T D; Hallman, T J; Hamed, A; Harris, J W; Heinz, M; Henry, T W; Hepplemann, S; Hippolyte, B; Hirsch, A; Hjort, E; Hoffmann, G W; Horner, M J; Huang, H Z; Huang, S L; Hughes, E W; Humanic, T J; Igo, G; Ishihara, A; Jacobs, P; Jacobs, W W; Jiang, H; Jones, P G; Judd, E G; Kabana, S; Kang, K; Kaplan, M; Keane, D; Kechechyan, A; Khodyrev, V Yu; Kim, B C; Kiryluk, J; Kisiel, A; Kislov, E M; Klein, S R; Koetke, D D; Kollegger, T; Kopytine, M; Kotchenda, L; Kowalik, K L; Kramer, M; Kravtsov, P; Kravtsov, V I; Krueger, K; Kuhn, C; Kulikov, A I; Kumar, A; Kutuev, R Kh; Kuznetsov, A A; Lamb, R; Lamont, M A C; Landgraf, J M; Lange, S; Laue, F; Lauret, J; Lebedev, A; Lednicky, R; Lee, C-H; Lehocka, S; Levine, M J; Li, C; Li, Q; Li, Y; Lin, G; Lindenbaum, S J; Lisa, M A; Liu, F; Liu, H; Liu, J; Liu, L; Liu, Q J; Liu, Z; Ljubicic, T; Llope, W J; Long, H; Longacre, R S; Lopez-Noriega, M; Love, W A; Lu, Y; Ludlam, T; Lynn, D; Ma, G L; Ma, J G; Ma, Y G; Magestro, D; Mahajan, S; Mahapatra, D P; Majka, R; Mangotra, L K; Manweiler, R; Margetis, S; Markert, C; Martin, L; Marx, J N; Matis, H S; Matulenko, Yu A; McClain, C J; McShane, T S; Melnick, Yu; Meschanin, A; Miller, M L; Minaev, N G; Mironov, C; Mischke, A; Mishra, D K; Mitchell, J; Mioduszewski, S; Mohanty, B; Molnar, L; Moore, C F; Morozov, D A; Munhoz, M G; Nandi, B K; Nayak, S K; Nayak, T K; Nelson, J M; Netrakanti, P K; Nikitin, V A; Nogach, L V; Nurushev, S B; Odyniec, G; Ogawa, A; Okorokov, V; Oldenburg, M; Olson, D; Pal, S K; Panebratsev, Y; Panitkin, S Y; Pavlinov, A I; Pawlak, T; Peitzmann, T; Perevoztchikov, V; Perkins, C; Peryt, W; Petrov, V A; Phatak, S C; Picha, R; Planinic, M; Pluta, J; Porile, N; Porter, J; Poskanzer, A M; Potekhin, M; Potrebenikova, E; Potukuchi, B V K S; Prindle, D; Pruneau, C; Putschke, J; Rakness, G; Raniwala, R; Raniwala, S; Ravel, O; Ray, R L; Razin, S V; Reichhold, D; Reid, J G; Reinnarth, J; Renault, G; Retiere, F; Ridiger, A; Ritter, H G; Roberts, J B; Rogachevskiy, O V; Romero, J L; Rose, A; Roy, C; Ruan, L; Russcher, M J; Sahoo, R; Sakrejda, I; Salur, S; Sandweiss, J; Sarsour, M; Savin, I; Sazhin, P S; Schambach, J; Scharenberg, R P; Schmitz, N; Schweda, K; Seger, J; Selyuzhenkov, I; Seyboth, P; Shabetai, A; Shahaliev, E; Shao, M; Shao, W; Sharma, M; Shen, W Q; Shestermanov, K E; Shimanskiy, S S; Sichtermann, E; Simon, F; Singaraju, R N; Smirnov, N; Snellings, R; Sood, G; Sorensen, P; Sowinski, J; Speltz, J; Spinka, H M; Srivastava, B; Stadnik, A; Stanislaus, T D S; Stock, R; Stolpovsky, A; Strikhanov, M; Stringfellow, B; Suaide, A A P; Sugarbaker, E; Sumbera, M; Surrow, B; Swanger, M; Symons, T J M; de Toledo, A Szanto; Tai, A; Takahashi, J; Tang, A H; Tarnowsky, T; Thein, D; Thomas, J H; Timmins, A R; Timoshenko, S; Tokarev, M; Trainor, T A; Trentalange, S; Tribble, R E; Tsai, O D; Ulery, J; Ullrich, T; Underwood, D G; Buren, G Van; van der Kolk, N; van Leeuwen, M; Molen, A M Vander; Varma, R; Vasilevski, I M; Vasiliev, A N; Vernet, R; Vigdor, S E; Viyogi, Y P; Vokal, S; Voloshin, S A; Waggoner, W T; Wang, F; Wang, G; Wang, G; Wang, X L; Wang, Y; Wang, Y; Wang, Z M; Ward, H; Watson, J W; Webb, J C; Westfall, G D; Wetzler, A; Whitten, C; Wieman, H; Wissink, S W; Witt, R; Wood, J; Wu, J; Xu, N; Xu, Q H; Xu, Z; Xu, Z Z; Yepes, P; Yoo, I-K; Yurevich, V I; Zborovsky, I; Zhang, H; Zhang, W M; Zhang, Y; Zhang, Z P; Zhong, C; Zoulkarneev, R; Zoulkarneeva, Y; Zubarev, A N; Zuo, J X

    2006-10-13

    Measurements of the production of forward pi0 mesons from p + p and d + Au collisions at square root sNN=200 GeV are reported. The p + p yield generally agrees with next-to-leading order perturbative QCD calculations. The d + Au yield per binary collision is suppressed as eta increases, decreasing to approximately 30% of the p + p yield at eta =4.00, well below shadowing expectations. Exploratory measurements of azimuthal correlations of the forward pi0 with charged hadrons at eta approximately 0 show a recoil peak in p + p that is suppressed in d + Au at low pion energy. These observations are qualitatively consistent with a saturation picture of the low-x gluon structure of heavy nuclei.

  14. Improving multilevel Monte Carlo for stochastic differential equations with application to the Langevin equation.

    PubMed

    Müller, Eike H; Scheichl, Rob; Shardlow, Tony

    2015-04-08

    This paper applies several well-known tricks from the numerical treatment of deterministic differential equations to improve the efficiency of the multilevel Monte Carlo (MLMC) method for stochastic differential equations (SDEs) and especially the Langevin equation. We use modified equations analysis as an alternative to strong-approximation theory for the integrator, and we apply this to introduce MLMC for Langevin-type equations with integrators based on operator splitting. We combine this with extrapolation and investigate the use of discrete random variables in place of the Gaussian increments, which is a well-known technique for the weak approximation of SDEs. We show that, for small-noise problems, discrete random variables can lead to an increase in efficiency of almost two orders of magnitude for practical levels of accuracy.

  15. A geochemical record of the mining history of the Erme Estuary, south Devon, UK.

    PubMed

    Price, Gregory D; Winkle, Karen; Gehrels, W Roland

    2005-12-01

    The concentration of selected trace metals (Cu, Pb and Zn) in salt-marsh sediments from within the Erme Estuary have been measured in order to assess possible historical sources of pollution. The Erme Estuary, south Devon, UK is an Area of Outstanding Natural Beauty and has remained largely unaffected by industrialisation, although a number of small silver-lead mines were in operation in the 1800s. Five cores reveal comparable geochemical profiles. An increase of lead at approximately 40 cm depth is observed, reaching maximum values of 427 ppm. Less distinct trends are revealed by zinc and copper, probably reflecting the lack of widespread mining for ores of these elements within the catchment and possible post-depositional mobility rendering the metal concentrations non-contemporaneous with the chemostratigraphy of lead. The geochemical analysis of the salt-marsh sediments provides a fairly robust chemostratigraphic scheme and the likely sources of mine waste can be pinpointed within the catchment. Based upon reference to the historical mining record of these mines chemostratigraphic dating of the sediments can be achieved in order to provide an estimate of salt-marsh accretion rates and sea-level rise.

  16. Probing gluon saturation with next-to-leading order photon production at central rapidities in proton-nucleus collisions

    DOE PAGES

    Benic, Sanjin; Fukushima, Kenji; Garcia-Montero, Oscar; ...

    2017-01-26

    Here, we compute the cross section for photons emitted from sea quarks in proton-nucleus collisions at collider energies. The computation is performed within the dilute-dense kinematics of the Color Glass Condensate (CGC) effective field theory. Albeit the result obtained is formally at next-to-leading order in the CGC power counting, it provides the dominant contribution for central rapidities. We observe that the inclusive photon cross section is proportional to all-twist Wilson line correlators in the nucleus. These correlators also appear in quark-pair production; unlike the latter, photon production is insensitive to hadronization uncertainties and therefore more sensitive to multi-parton correlations inmore » the gluon saturation regime of QCD. We demonstrate that k ⊥ and collinear factorized expressions for inclusive photon production are obtained as leading twist approximations to our result. In particular, the collinearly factorized expression is directly sensitive to the nuclear gluon distribution at small x. Other results of interest include the realization of the Low-Burnett-Kroll soft photon theorem in the CGC framework and a comparative study of how the photon amplitude is obtained in Lorenz and light-cone gauges.« less

  17. Relativistic corrections to the ground state of H2 calculated without using the Born-Oppenheimer approximation

    NASA Astrophysics Data System (ADS)

    Wang, L. M.; Yan, Z.-C.

    2018-06-01

    The Schrödinger equation for the ground state of the hydrogen molecule H2 is solved by applying the Rayleigh-Ritz variational method in Hylleraas coordinates without using the Born-Oppenheimer approximation. The nonrelativistic energy eigenvalue is converged to -1.164 025 030 880 (7 ) atomic units. The leading-order relativistic corrections, including the mass-velocity, Darwin, orbit-orbit, spin-spin, and relativistic recoil terms, are evaluated perturbatively. Together with the higher-order relativistic and quantum electrodynamic corrections obtained by Puchalski et al. [Phys. Rev. Lett. 117, 263002 (2016), 10.1103/PhysRevLett.117.263002], we determine the dissociation energy of the hydrogen molecule, D0=36 118.069 71 (33 ) cm-1 , which agrees with the two recent experimental results of Liu et al. [J. Chem. Phys. 130, 174306 (2009), 10.1063/1.3120443], 36 118.069 62 (37 ) cm-1 , and Altmann et al. [Phys. Rev. Lett. 120, 043204 (2018), 10.1103/PhysRevLett.120.043204], 36 118.069 45 (31 ) cm-1 .

  18. The Dynamics of Current Carriers In Standing Alfven Waves

    NASA Astrophysics Data System (ADS)

    Wright, A. N.; Allan, W.; Ruderman, M. S.; Elphic, R. C.

    The acceleration of current carriers in an Alfvén wave current system is considered. The model incorporates a dipole magnetic field geometry, and we present an analyt- ical solution of the two-fluid equations by successive approximations. The leading solution corresponds to the familiar single-fluid toroidal oscillations. The next order describes the nonlinear dynamics of electrons responsible for carrying a few µAm-2 field aligned current into the ionosphere. The solution shows how most of the elec- tron acceleration in the magnetosphere occurs within 1 RE of the ionosphere, and that a parallel electric field of the order of 1 mVm-1 is reponsible for energising the electrons to 1 keV. The limitations of the electron fluid approximation are considered, and a qualitative solution including electron beams and a modified E is developed in accord with observations. We find that the electron acceleration can be nonlinear, (ve )ve > ve , as a result of our nonuniform equilibrium field geometry even when ve is less than the Alfvén speed. Our calculation also elucidates the processes through which E is generated and supported.

  19. On the conservation of the Jacobi integral in the post-Newtonian circular restricted three-body problem

    NASA Astrophysics Data System (ADS)

    Dubeibe, F. L.; Lora-Clavijo, F. D.; González, Guillermo A.

    2017-05-01

    In the present paper, using the first-order approximation of the n-body Lagrangian (derived on the basis of the post-Newtonian gravitational theory of Einstein, Infeld, and Hoffman), we explicitly write down the equations of motion for the planar circular restricted three-body problem in the Solar system. Additionally, with some simplified assumptions, we obtain two formulas for estimating the values of the mass-distance and velocity-speed of light ratios appropriate for a given post-Newtonian approximation. We show that the formulas derived in the present study, lead to good numerical accuracy in the conservation of the Jacobi constant and almost allow for an equivalence between the Lagrangian and Hamiltonian approaches at the same post-Newtonian order. Accordingly, the dynamics of the system is analyzed in terms of the Poincaré sections method and Lyapunov exponents, finding that for specific values of the Jacobi constant the dynamics can be either chaotic or regular. Our results suggest that the chaoticity of the post-Newtonian system is slightly increased in comparison with its Newtonian counterpart.

  20. A Simple Method for High-Lift Propeller Conceptual Design

    NASA Technical Reports Server (NTRS)

    Patterson, Michael; Borer, Nick; German, Brian

    2016-01-01

    In this paper, we present a simple method for designing propellers that are placed upstream of the leading edge of a wing in order to augment lift. Because the primary purpose of these "high-lift propellers" is to increase lift rather than produce thrust, these props are best viewed as a form of high-lift device; consequently, they should be designed differently than traditional propellers. We present a theory that describes how these props can be designed to provide a relatively uniform axial velocity increase, which is hypothesized to be advantageous for lift augmentation based on a literature survey. Computational modeling indicates that such propellers can generate the same average induced axial velocity while consuming less power and producing less thrust than conventional propeller designs. For an example problem based on specifications for NASA's Scalable Convergent Electric Propulsion Technology and Operations Research (SCEPTOR) flight demonstrator, a propeller designed with the new method requires approximately 15% less power and produces approximately 11% less thrust than one designed for minimum induced loss. Higher-order modeling and/or wind tunnel testing are needed to verify the predicted performance.

  1. Multipolar second harmonic generation in a symmetric nonlinear metamaterial

    DOE PAGES

    Wolf, Omri; Campione, Salvatore; Yang, Yuanmu; ...

    2017-08-14

    Optical nonlinearities are intimately related to the spatial symmetry of the nonlinear media. For example, the second order susceptibility vanishes for centrosymmetric materials under the dipole approximation. The latter concept has been naturally extended to the metamaterials’ realm, sometimes leading to the (erroneous) hypothesis that second harmonic (SH) generation is negligible in highly symmetric meta-atoms. In this work we aim to show that such symmetric meta-atoms can radiate SH light efficiently. In particular, we investigate in-plane centrosymmetric meta-atom designs where the approximation for meta-atoms breaks down. In a periodic array this building block allows us to control the directionality ofmore » the SH radiation. We conclude by showing that the use of symmetry considerations alone allows for the manipulation of the nonlinear multipolar response of a meta-atom, resulting in e.g. dipolar, quadrupolar, or multipolar emission on demand. This is because the size of the meta-atom is comparable with the free-space wavelength, thus invalidating the dipolar approximation for meta-atoms.« less

  2. On HPM approximation for the perihelion precession angle in general relativity

    NASA Astrophysics Data System (ADS)

    Shchigolev, Victor; Bezbatko, Dmitrii

    2017-03-01

    In this paper, the homotopy perturbation method (HPM) is applied for calculating the perihelion precession angle of planetary orbits in General Relativity. The HPM is quite efficient and is practically well suited for use in many astrophysical and cosmological problems. For our purpose, we applied HPM to the approximate solutions for the orbits in order to calculate the perihelion shift. On the basis of the main idea of HPM, we construct the appropriate homotopy that leads to the problem of solving the set of linear algebraic equations. As a result, we obtain a simple formula for the angle of precession avoiding any restrictions on the smallness of physical parameters. First of all, we consider the simple examples of the Schwarzschild metric and the Reissner - Nordström spacetime of a charged star for which the approximate geodesics solutions are known. Furthermore, the implementation of HPM has allowed us to readily obtain the precession angle for the orbits in the gravitational field of Kiselev black hole.

  3. Design and experimental evaluation of robust controllers for a two-wheeled robot

    NASA Astrophysics Data System (ADS)

    Kralev, J.; Slavov, Ts.; Petkov, P.

    2016-11-01

    The paper presents the design and experimental evaluation of two alternative μ-controllers for robust vertical stabilisation of a two-wheeled self-balancing robot. The controllers design is based on models derived by identification from closed-loop experimental data. In the first design, a signal-based uncertainty representation obtained directly from the identification procedure is used, which leads to a controller of order 29. In the second design the signal uncertainty is approximated by an input multiplicative uncertainty, which leads to a controller of order 50, subsequently reduced to 30. The performance of the two μ-controllers is compared with the performance of a conventional linear quadratic controller with 17th-order Kalman filter. A proportional-integral controller of the rotational motion around the vertical axis is implemented as well. The control code is generated using Simulink® controller models and is embedded in a digital signal processor. Results from the simulation of the closed-loop system as well as experimental results obtained during the real-time implementation of the designed controllers are given. The theoretical investigation and experimental results confirm that the closed-loop system achieves robust performance in respect to the uncertainties related to the identified robot model.

  4. Large-scale structure in brane-induced gravity. I. Perturbation theory

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Scoccimarro, Roman

    2009-11-15

    We study the growth of subhorizon perturbations in brane-induced gravity using perturbation theory. We solve for the linear evolution of perturbations taking advantage of the symmetry under gauge transformations along the extra-dimension to decouple the bulk equations in the quasistatic approximation, which we argue may be a better approximation at large scales than thought before. We then study the nonlinearities in the bulk and brane equations, concentrating on the workings of the Vainshtein mechanism by which the theory becomes general relativity (GR) at small scales. We show that at the level of the power spectrum, to a good approximation, themore » effect of nonlinearities in the modified gravity sector may be absorbed into a renormalization of the gravitational constant. Since the relation between the lensing potential and density perturbations is entirely unaffected by the extra physics in these theories, the modified gravity can be described in this approximation by a single function, an effective gravitational constant for nonrelativistic motion that depends on space and time. We develop a resummation scheme to calculate it, and provide predictions for the nonlinear power spectrum. At the level of the large-scale bispectrum, the leading order corrections are obtained by standard perturbation theory techniques, and show that the suppression of the brane-bending mode leads to characteristic signatures in the non-Gaussianity generated by gravity, generic to models that become GR at small scales through second-derivative interactions. We compare the predictions in this work to numerical simulations in a companion paper.« less

  5. Renormalization scheme dependence of high-order perturbative QCD predictions

    NASA Astrophysics Data System (ADS)

    Ma, Yang; Wu, Xing-Gang

    2018-02-01

    Conventionally, one adopts typical momentum flow of a physical observable as the renormalization scale for its perturbative QCD (pQCD) approximant. This simple treatment leads to renormalization scheme-and-scale ambiguities due to the renormalization scheme and scale dependence of the strong coupling and the perturbative coefficients do not exactly cancel at any fixed order. It is believed that those ambiguities will be softened by including more higher-order terms. In the paper, to show how the renormalization scheme dependence changes when more loop terms have been included, we discuss the sensitivity of pQCD prediction on the scheme parameters by using the scheme-dependent {βm ≥2}-terms. We adopt two four-loop examples, e+e-→hadrons and τ decays into hadrons, for detailed analysis. Our results show that under the conventional scale setting, by including more-and-more loop terms, the scheme dependence of the pQCD prediction cannot be reduced as efficiently as that of the scale dependence. Thus a proper scale-setting approach should be important to reduce the scheme dependence. We observe that the principle of minimum sensitivity could be such a scale-setting approach, which provides a practical way to achieve optimal scheme and scale by requiring the pQCD approximate be independent to the "unphysical" theoretical conventions.

  6. Expanding wave solutions of the Einstein equations that induce an anomalous acceleration into the Standard Model of Cosmology.

    PubMed

    Temple, Blake; Smoller, Joel

    2009-08-25

    We derive a system of three coupled equations that implicitly defines a continuous one-parameter family of expanding wave solutions of the Einstein equations, such that the Friedmann universe associated with the pure radiation phase of the Standard Model of Cosmology is embedded as a single point in this family. By approximating solutions near the center to leading order in the Hubble length, the family reduces to an explicit one-parameter family of expanding spacetimes, given in closed form, that represents a perturbation of the Standard Model. By introducing a comoving coordinate system, we calculate the correction to the Hubble constant as well as the exact leading order quadratic correction to the redshift vs. luminosity relation for an observer at the center. The correction to redshift vs. luminosity entails an adjustable free parameter that introduces an anomalous acceleration. We conclude (by continuity) that corrections to the redshift vs. luminosity relation observed after the radiation phase of the Big Bang can be accounted for, at the leading order quadratic level, by adjustment of this free parameter. The next order correction is then a prediction. Since nonlinearities alone could actuate dissipation and decay in the conservation laws associated with the highly nonlinear radiation phase and since noninteracting expanding waves represent possible time-asymptotic wave patterns that could result, we propose to further investigate the possibility that these corrections to the Standard Model might be the source of the anomalous acceleration of the galaxies, an explanation not requiring the cosmological constant or dark energy.

  7. Determination of intermediate perturbed orbits of Near-Earth asteroids from range and range rate measurements at three times

    NASA Astrophysics Data System (ADS)

    Shefer, V. A.

    2014-12-01

    Two methods that the author developed earlier for finding the intermediate perturbed orbit of a small celestial body from three pairs of range and range rate observations [1, 2] are applied to the determination of orbits of Near-Earth asteroids. The methods are based on using the superosculating orbits with three- and fourth-order tangency. The degrees of approximation of the real motion by the constructed intermediate orbits near the middle measurement time are two and three orders of magnitude higher than by the Keplerian orbit determined with the help of traditional methods. We calculated the orbits of the asteroids 99942 Apophis, 1566 Icarus, 4179 Toutatis, 2007 DN41 and 2012 DA14. For the sake of brevity, we call the method based on the orbit with third-order tangency as Algorithm A1 and the method based on the orbit with fourth-order tangency -- as Algorithm A2. The results of the calculations are compared with the results of the calculations by the version of the methods mentioned that allows us to construct the unperturbed Keplerian orbit. We call this version of the methods as Algorithm A. The observational data were simulated using the nominal trajectories of the selected asteroids. These trajectories were obtained by the numerical integration of the differential equations of motion subject to the perturbations from the eight major planets, Pluto, and the Moon. The integration was carried out with the help of the 15-order Everhart procedure [3]. The main results of the calculations are the following. When the reference time interval is shortened by half (for small sizes of this interval), the errors in the compared algorithms A, A1, A2 decrease approximately by the factors 4, 16, 64 in coordinates and by the factors 2, 8, 16 in velocities, respectively. Such behavior of the errors is most clearly seen with the asteroids 2007 DN41 and 2012 DA14. This leads to a significant increase in the accuracy of the real motion approximation by the intermediate orbits constructed using the A1 and A2 algorithms (2-4 orders of magnitude in coordinates and 4-7 orders of magnitude in velocities higher) compared to the accuracy of the approximation by Keplerian orbits with decreasing the reference arc of the trajectory. Here, the higher is the efficiency of the algorithms A1 and A2, the smaller are the values of the topocentric distances, i.e., the greater are the perturbations caused by the Earth's gravitation. The advantage of Algorithm A2 over Algorithm A1 in accuracy extends approximately one order of magnitude. The minimal methodic errors of the position vector by using the A1 and A2 algorithms range from several meters in the case of the asteroid Apophis to several millimeters in the case of the asteroid 2012 DA14. Hence, the numerical examples analyzed in this work lead us to conclude that the proposed in [1, 2] methods for determination of an intermediate perturbed orbit from range and range rate measurements at three time points allow for significantly raising the accuracy of the calculation of the initial asteroid orbits in comparison with the algorithm based on the finding the unperturbed Keplerian orbit. The shorter is the orbital arc specified by the extreme time points, the greater is the advantage of the algorithms suggested over the algorithms of the traditional approach in the accuracy. The advantage of the algorithms suggested in the accuracy increases with raising the perturbations too, which is especially important for calculation of the initial trajectories of the space objects detected in the Earth's neighbourhood. The work was supported by the Ministry of Education and Science of the Russian Federation, project no. 2014/223(1567).

  8. A theory of post-stall transients in axial compression systems. I - Development of equations

    NASA Technical Reports Server (NTRS)

    Moore, F. K.; Greitzer, E. M.

    1985-01-01

    An approximate theory is presented for post-stall transients in multistage axial compression systems. The theory leads to a set of three simultaneous nonlinear third-order partial differential equations for pressure rise, and average and disturbed values of flow coefficient, as functions of time and angle around the compressor. By a Galerkin procedure, angular dependence is averaged, and the equations become first order in time. These final equations are capable of describing the growth and possible decay of a rotating-stall cell during a compressor mass-flow transient. It is shown how rotating-stall-like and surgelike motions are coupled through these equations, and also how the instantaneous compressor pumping characteristic changes during the transient stall process.

  9. Aeroservoelasticity

    NASA Technical Reports Server (NTRS)

    Noll, Thomas E.

    1990-01-01

    The paper describes recent accomplishments and current research projects along four main thrusts in aeroservoelasticity at NASA Langley. One activity focuses on enhancing the modeling and analysis procedures to accurately predict aeroservoelastic interactions. Improvements to the minimum-state method of approximating unsteady aerodynamics are shown to provide precise low-order models for design and simulation tasks. Recent extensions in aerodynamic correction-factor methodology are also described. With respect to analysis procedures, the paper reviews novel enhancements to matched filter theory and random process theory for predicting the critical gust profile and the associated time-correlated gust loads for structural design considerations. Two research projects leading towards improved design capability are also summarized: (1) an integrated structure/control design capability and (2) procedures for obtaining low-order robust digital control laws for aeroelastic applications.

  10. Determination of lead in bone tissues by axially viewed inductively coupled plasma multichannel-based emission spectrometry.

    PubMed

    Grotti, Marco; Abelmoschi, Maria Luisa; Dalla Riva, Simona; Soggia, Francesco; Frache, Roberto

    2005-04-01

    A new procedure for determining low levels of lead in bone tissues has been developed. After wet acid digestion in a pressurized microwave-heated system, the solution was analyzed by inductively coupled plasma multichannel-based emission spectrometry. Internal standardization using the Co 228.615 nm reference line was chosen as the optimal method to compensate for the matrix effects from the presence of calcium and nitric acid at high concentration levels. The detection limit of the procedure was 0.11 microg Pb g(-1) dry mass. Instrumental precision at the analytical concentration of approximately 10 microg l(-1) ranged from 6.1 to 9.4%. Precision of the sample preparation step was 5.4%. The concentration of lead in SRM 1486 (1.32+/-0.04 microg g(-1)) found using the new procedure was in excellent agreement with the certified level (1.335+/-0.014 microg g(-1)). Finally, the method was applied to determine the lead in various fish bone tissues, and the analytical results were found to be in good agreement with those obtained through differential pulse anodic stripping voltammetry. The method is therefore suitable for the reliable determination of lead at concentration levels of below 1 microg g(-1) in bone samples. Moreover, the multi-element capability of the technique allows us to simultaneously determine other major or trace elements in order to investigate inter-element correlation and to compute enrichment factors, making the proposed procedure particularly useful for investigating lead occurrence and pathways in fish bone tissues in order to find suitable biomarkers for the Antarctic marine environment.

  11. Deaths: leading causes for 2007.

    PubMed

    Heron, Melonie

    2011-08-26

    This report presents final 2007 data on the 10 leading causes of death in the United States by age, race, sex, and Hispanic origin. Leading causes of infant, neonatal, and postneonatal death are also presented. This report supplements the Division of Vital Statistics' annual report of final mortality statistics. Data in this report are based on information from all death certificates filed in the 50 states and the District of Columbia in 2007. Causes of death classified by the International Classification of Diseases, Tenth Revision (ICD-10) are ranked according to the number of deaths assigned to rankable causes. Cause-of-death statistics are based on the underlying cause of death. In 2007, the 10 leading causes of death were, in rank order: Diseases of heart; Malignant neoplasms; Cerebrovascular diseases; Chronic lower respiratory diseases; Accidents (unintentional injuries); Alzheimer's disease; Diabetes mellitus; Influenza and pneumonia; Nephritis, nephrotic syndrome and nephrosis; and Septicemia. They accounted for approximately 76 percent of all deaths occurring in the United States. Differences in the rankings are evident by age, sex, race, and Hispanic origin. Leading causes of infant death for 2007 were, in rank order: Congenital malformations, deformations and chromosomal abnormalities; Disorders related to short gestation and low birth weight, not elsewhere classified; Sudden infant death syndrome; Newborn affected by maternal complications of pregnancy; Accidents (unintentional injuries); Newborn affected by complications of placenta, cord and membranes; Bacterial sepsis of newborn; Respiratory distress of newborn; Diseases of the circulatory system; and Neonatal hemorrhage. Important variations in the leading causes of infant death are noted for the neonatal and postneonatal periods.

  12. Deaths: leading causes for 2009.

    PubMed

    Heron, Melonie

    2012-10-26

    This report presents final 2009 data on the 10 leading causes of death in the United States by age, sex, race, and Hispanic origin. Leading causes of infant, neonatal, and postneonatal death are also presented. This report supplements the Division of Vital Statistics' annual report of final mortality statistics. Data in this report are based on information from all death certificates filed in the 50 states and the District of Columbia in 2009. Causes of death classified by the International Classification of Diseases, Tenth Revision (ICD-10) are ranked according to the number of deaths assigned to rankable causes. Cause-of-death statistics are based on the underlying cause of death. In 2009, the 10 leading causes of death were, in rank order: Diseases of heart; Malignant neoplasms; Chronic lower respiratory diseases; Cerebrovascular diseases; Accidents (unintentional injuries); Alzheimer's disease; Diabetes mellitus; Influenza and pneumonia; Nephritis, nephrotic syndrome and nephrosis; and Intentional self-harm (suicide). These causes accounted for approximately 75% of all deaths occurring in the United States. Differences in the rankings are evident by age, sex, race, and Hispanic origin. Leading causes of infant death for 2009 were, in rank order: Congenital malformations, deformations and chromosomal abnormalities; Disorders related to short gestation and low birth weight, not elsewhere classified; Sudden infant death syndrome; Newborn affected by maternal complications of pregnancy; Accidents (unintentional injuries); Newborn affected by complications of placenta, cord and membranes; Bacterial sepsis of newborn; Respiratory distress of newborn; Diseases of the circulatory system; and Neonatal hemorrhage. Important variations in the leading causes of infant death are noted for the neonatal and postneonatal periods.

  13. Deaths: leading causes for 2008.

    PubMed

    Heron, Melonie

    2012-06-06

    This report presents final 2008 data on the 10 leading causes of death in the United States by age, sex, race, and Hispanic origin. Leading causes of infant, neonatal, and postneonatal death are also presented. This report supplements the Division of Vital Statistics' annual report of final mortality statistics. Data in this report are based on information from all death certificates filed in the 50 states and the District of Columbia in 2008. Causes of death classified by the International Classification of Diseases, Tenth Revision (ICD-10) are ranked according to the number of deaths assigned to rankable causes. Cause-of-death statistics are based on the underlying cause of death. in 2008, the 10 leading causes of death were, in rank order: Diseases of heart; Malignant neoplasms; Chronic lower respiratory diseases; Cerebrovascular diseases; Accidents (unintentional injuries); Alzheimer's disease; Diabetes mellitus; Influenza and pneumonia; Nephritis, nephrotic syndrome and nephrosis; and Intentional self-harm (suicide). They accounted for approximately 76 percent of all deaths occurring in the United States. Differences in the rankings are evident by age, sex, race, and Hispanic origin. Leading causes of infant death for 2008 were, in rank order: Congenital malformations, deformations and chromosomal abnormalities; Disorders related to short gestation and low birth weight, not elsewhere classified; Sudden infant death syndrome; Newborn affected by maternal complications of pregnancy; Accidents (unintentional injuries); Newborn affected by complications of placenta, cord and membranes; Bacterial sepsis of newborn; Respiratory distress of newborn; Diseases of the circulatory system; and Neonatal hemorrhage. Important variations in the leading causes of infant death are noted for the neonatal and postneonatal periods.

  14. A new quasi-relativistic approach for density functional theory based on the normalized elimination of the small component

    NASA Astrophysics Data System (ADS)

    Filatov, Michael; Cremer, Dieter

    2002-01-01

    A recently developed variationally stable quasi-relativistic method, which is based on the low-order approximation to the method of normalized elimination of the small component, was incorporated into density functional theory (DFT). The new method was tested for diatomic molecules involving Ag, Cd, Au, and Hg by calculating equilibrium bond lengths, vibrational frequencies, and dissociation energies. The method is easy to implement into standard quantum chemical programs and leads to accurate results for the benchmark systems studied.

  15. Conforming and nonconforming virtual element methods for elliptic problems

    DOE PAGES

    Cangiani, Andrea; Manzini, Gianmarco; Sutton, Oliver J.

    2016-08-03

    Here we present, in a unified framework, new conforming and nonconforming virtual element methods for general second-order elliptic problems in two and three dimensions. The differential operator is split into its symmetric and nonsymmetric parts and conditions for stability and accuracy on their discrete counterparts are established. These conditions are shown to lead to optimal H 1- and L 2-error estimates, confirmed by numerical experiments on a set of polygonal meshes. The accuracy of the numerical approximation provided by the two methods is shown to be comparable.

  16. Game Theoretic Approach to Post-Docked Satellite Control

    NASA Technical Reports Server (NTRS)

    Hiramatsu, Takashi; Fitz-Coy, Norman G.

    2007-01-01

    This paper studies the interaction between two satellites after docking. In order to maintain the docked state with uncertainty in the motion of the target vehicle, a game theoretic controller with Stackelberg strategy to minimize the interaction between the satellites is considered. The small perturbation approximation leads to LQ differential game scheme, which is validated to address the docking interactions between a service vehicle and a target vehicle. The open-loop solution are compared with Nash strategy, and it is shown that less control efforts are obtained with Stackelberg strategy.

  17. Glaucoma in juvenile xanthogranuloma.

    PubMed

    Vendal, Zarmeena; Walton, David; Chen, Teresa

    2006-01-01

    Juvenile xanthogranuloma (JXG) is a benign histiocytic skin disorder mainly encountered during infancy. Approximately 10% of cases exhibit ocular manifestations leading to serious complications. Specifically, secondary glaucoma can result in severe and blinding eye disease. We present a case of a two-month-old female with JXG related glaucoma in order to demonstrate the classic presentation and the problems commonly encountered in treating this disease. The natural history, pathogenesis, and treatment of the condition are then discussed and the pertinent literature reviewed. JXG should be considered in any case of unilateral glaucoma that presents in infancy.

  18. Precise QCD Predictions for the Production of a Z Boson in Association with a Hadronic Jet.

    PubMed

    Gehrmann-De Ridder, A; Gehrmann, T; Glover, E W N; Huss, A; Morgan, T A

    2016-07-08

    We compute the cross section and differential distributions for the production of a Z boson in association with a hadronic jet to next-to-next-to-leading order (NNLO) in perturbative QCD, including the leptonic decay of the Z boson. We present numerical results for the transverse momentum and rapidity distributions of both the Z boson and the associated jet at the LHC. We find that the NNLO corrections increase the NLO predictions by approximately 1% and significantly reduce the scale variation uncertainty.

  19. Conforming and nonconforming virtual element methods for elliptic problems

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Cangiani, Andrea; Manzini, Gianmarco; Sutton, Oliver J.

    Here we present, in a unified framework, new conforming and nonconforming virtual element methods for general second-order elliptic problems in two and three dimensions. The differential operator is split into its symmetric and nonsymmetric parts and conditions for stability and accuracy on their discrete counterparts are established. These conditions are shown to lead to optimal H 1- and L 2-error estimates, confirmed by numerical experiments on a set of polygonal meshes. The accuracy of the numerical approximation provided by the two methods is shown to be comparable.

  20. Conical flow near singular rays. [shock generation in ideal gas

    NASA Technical Reports Server (NTRS)

    Zahalak, G. I.; Myers, M. K.

    1974-01-01

    The steady flow of an ideal gas past a conical body is investigated by the method of matched asymptotic expansions, with particular emphasis on the flow near the singular ray occurring in linearized theory. The first-order problem governing the flow in this region is formulated, leading to the equation of Kuo, and an approximate solution is obtained in the case of compressive flow behind the main front. This solution is compared with the results of previous investigations with a view to assessing the applicability of the Lighthill-Whitham theories.

  1. A comparison of visual and kinesthetic-tactual displays for compensatory tracking

    NASA Technical Reports Server (NTRS)

    Jagacinski, R. J.; Flach, J. M.; Gilson, R. D.

    1983-01-01

    Recent research on manual tracking with a kinesthetic-tactual (KT) display suggests that under certain conditions it can be an effective alternative or supplement to visual displays. In order to understand better how KT tracking compares with visual tracking, both a critical tracking and stationary single-axis tracking tasks were conducted with and without velocity quickening. In the critical tracking task, the visual displays were superior, however, the quickened KT display was approximately equal to the unquickened visual display. In stationary tracking tasks, subjects adopted lag equalization with the quickened KT and visual displays, and mean-squared error scores were approximately equal. With the unquickened displays, subjects adopted lag-lead equalization, and the visual displays were superior. This superiority was partly due to the servomotor lag in the implementation of the KT display and partly due to modality differences.

  2. A comparison of tracking with visual and kinesthetic-tactual displays

    NASA Technical Reports Server (NTRS)

    Jagacinski, R. J.; Flach, J. M.; Gilson, R. D.

    1981-01-01

    Recent research on manual tracking with a kinesthetic-tactual (KT) display suggests that under appropriate conditions it may be an effective means of providing visual workload relief. In order to better understand how KT tracking differs from visual tracking, both a critical tracking task and stationary single-axis tracking tasks were conducted with and without velocity quickening. On the critical tracking task, the visual displays were superior; however, the KT quickened display was approximately equal to the visual unquickened display. Mean squared error scores in the stationary tracking tasks for the visual and KT displays were approximately equal in the quickened conditions, and the describing functions were very similar. In the unquickened conditions, the visual display was superior. Subjects using the unquickened KT display exhibited a low frequency lead-lag that may be related to sensory adaptation.

  3. Numerical studies of the margin of vortices with decaying cores

    NASA Technical Reports Server (NTRS)

    Liu, G. C.; Ting, L.

    1986-01-01

    The merging of vortices to a single one is a canonical incompressible viscous flow problem. The merging process begins when the core sizes or the vortices are comparable to their distances and ends when the contour lines of constant vorticity lines are circularized around one center. Approximate solutions to this problem are constructed by adapting the asymptotic solutions for distinct vortices. For the early stage of merging, the next-order terms in the asymptotic solutions are added to the leading term. For the later stage of merging, the vorticity distribution is reinitialized by vortices with overlapping core structures guided by the 'rule of merging' and the velocity of the 'vortex centers' are then defined by a minimum principle. To show the accuracy of the approximate solution, it is compared with the finite-difference solution.

  4. Anomalous Growth of Aging Populations

    NASA Astrophysics Data System (ADS)

    Grebenkov, Denis S.

    2016-04-01

    We consider a discrete-time population dynamics with age-dependent structure. At every time step, one of the alive individuals from the population is chosen randomly and removed with probability q_k depending on its age, whereas a new individual of age 1 is born with probability r. The model can also describe a single queue in which the service order is random while the service efficiency depends on a customer's "age" in the queue. We propose a mean field approximation to investigate the long-time asymptotic behavior of the mean population size. The age dependence is shown to lead to anomalous power-law growth of the population at the critical regime. The scaling exponent is determined by the asymptotic behavior of the probabilities q_k at large k. The mean field approximation is validated by Monte Carlo simulations.

  5. Vanishing-Overhead Linear-Scaling Random Phase Approximation by Cholesky Decomposition and an Attenuated Coulomb-Metric.

    PubMed

    Luenser, Arne; Schurkus, Henry F; Ochsenfeld, Christian

    2017-04-11

    A reformulation of the random phase approximation within the resolution-of-the-identity (RI) scheme is presented, that is competitive to canonical molecular orbital RI-RPA already for small- to medium-sized molecules. For electronically sparse systems drastic speedups due to the reduced scaling behavior compared to the molecular orbital formulation are demonstrated. Our reformulation is based on two ideas, which are independently useful: First, a Cholesky decomposition of density matrices that reduces the scaling with basis set size for a fixed-size molecule by one order, leading to massive performance improvements. Second, replacement of the overlap RI metric used in the original AO-RPA by an attenuated Coulomb metric. Accuracy is significantly improved compared to the overlap metric, while locality and sparsity of the integrals are retained, as is the effective linear scaling behavior.

  6. A general formula for Rayleigh-Schroedinger perturbation energy utilizing a power series expansion of the quantum mechanical Hamiltonian

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Herbert, J.M.

    1997-02-01

    Perturbation theory has long been utilized by quantum chemists as a method for approximating solutions to the Schroedinger equation. Perturbation treatments represent a system`s energy as a power series in which each additional term further corrects the total energy; it is therefore convenient to have an explicit formula for the nth-order energy correction term. If all perturbations are collected into a single Hamiltonian operator, such a closed-form expression for the nth-order energy correction is well known; however, use of a single perturbed Hamiltonian often leads to divergent energy series, while superior convergence behavior is obtained by expanding the perturbed Hamiltonianmore » in a power series. This report presents a closed-form expression for the nth-order energy correction obtained using Rayleigh-Schroedinger perturbation theory and a power series expansion of the Hamiltonian.« less

  7. String theory of the Regge intercept.

    PubMed

    Hellerman, S; Swanson, I

    2015-03-20

    Using the Polchinski-Strominger effective string theory in the covariant gauge, we compute the mass of a rotating string in D dimensions with large angular momenta J, in one or two planes, in fixed ratio, up to and including first subleading order in the large J expansion. This constitutes a first-principles calculation of the value for the order-J(0) contribution to the mass squared of a meson on the leading Regge trajectory in planar QCD with bosonic quarks. For open strings with Neumann boundary conditions, and for closed strings in D≥5, the order-J(0) term in the mass squared is exactly calculated by the semiclassical approximation. This term in the expansion is universal and independent of the details of the theory, assuming only D-dimensional Poincaré invariance and the absence of other infinite-range excitations on the string world volume, beyond the Nambu-Goldstone bosons.

  8. Efficient second harmonic generation by para-nitroaniline embedded in electro-spun polymeric nanofibres

    NASA Astrophysics Data System (ADS)

    Gonçalves, Hugo; Saavedra, Inês; Ferreira, Rute AS; Lopes, PE; de Matos Gomes, Etelvina; Belsley, Michael

    2018-03-01

    Intense well polarized second harmonic light was generated by poly(methyl methacrylate) nanofibres with embedded para-nitroaniline nanocrystals. Subwavelength diameter fibres were electro-spun using a 1:2 weight ratio of chromophore to polymer. Analysis of the generated second harmonic light indicates that the para-nitroaniline molecules, which nominally crystalize in the centrosymmetric space group, were organized into noncentrosymmetric structures leading to a second order susceptibility dominated by a single tensor element. Under the best deposition conditions, the nanofibrers display an effective nonlinear optical susceptibility approximately two orders of magnitude greater than that of potassium dihydrogen phosphate. Generalizing this approach to a broad range of organic molecules with strong individual molecular second order nonlinear responses, but which nominally form centrosymmetric organic crystals, could open a new pathway for the fabrication of efficient sub-micron sized second harmonic light generators.

  9. Second-order numerical methods for multi-term fractional differential equations: Smooth and non-smooth solutions

    NASA Astrophysics Data System (ADS)

    Zeng, Fanhai; Zhang, Zhongqiang; Karniadakis, George Em

    2017-12-01

    Starting with the asymptotic expansion of the error equation of the shifted Gr\\"{u}nwald--Letnikov formula, we derive a new modified weighted shifted Gr\\"{u}nwald--Letnikov (WSGL) formula by introducing appropriate correction terms. We then apply one special case of the modified WSGL formula to solve multi-term fractional ordinary and partial differential equations, and we prove the linear stability and second-order convergence for both smooth and non-smooth solutions. We show theoretically and numerically that numerical solutions up to certain accuracy can be obtained with only a few correction terms. Moreover, the correction terms can be tuned according to the fractional derivative orders without explicitly knowing the analytical solutions. Numerical simulations verify the theoretical results and demonstrate that the new formula leads to better performance compared to other known numerical approximations with similar resolution.

  10. UV conformal window for asymptotic safety

    NASA Astrophysics Data System (ADS)

    Bond, Andrew D.; Litim, Daniel F.; Vazquez, Gustavo Medina; Steudtner, Tom

    2018-02-01

    Interacting fixed points in four-dimensional gauge theories coupled to matter are investigated using perturbation theory up to three loop order. It is shown how fixed points, scaling exponents, and anomalous dimensions are obtained as a systematic power series in a small parameter. The underlying ordering principle is explained and contrasted with conventional perturbation theory and Weyl consistency conditions. We then determine the conformal window with asymptotic safety from the complete next-to-next-to-leading order in perturbation theory. Limits for the conformal window arise due to fixed point mergers, the onset of strong coupling, or vacuum instability. A consistent picture is uncovered by comparing various levels of approximation. The theory remains perturbative in the entire conformal window, with vacuum stability dictating the tightest constraints. We also speculate about a secondary conformal window at strong coupling and estimate its lower limit. Implications for model building and cosmology are indicated.

  11. Analytical Debye-Huckel model for electrostatic potentials around dissolved DNA.

    PubMed

    Wagner, K; Keyes, E; Kephart, T W; Edwards, G

    1997-07-01

    We present an analytical, Green-function-based model for the electric potential of DNA in solution, treating the surrounding solvent with the Debye-Huckel approximation. The partial charge of each atom is accounted for by modeling DNA as linear distributions of atoms on concentric cylindrical surfaces. The condensed ions of the solvent are treated with the Debye-Huckel approximation. The resultant leading term of the potential is that of a continuous shielded line charge, and the higher order terms account for the helical structure. Within several angstroms of the surface there is sufficient information in the electric potential to distinguish features and symmetries of DNA. Plots of the potential and equipotential surfaces, dominated by the phosphate charges, reflect the structural differences between the A, B, and Z conformations and, to a smaller extent, the difference between base sequences. As the distances from the helices increase, the magnitudes of the potentials decrease. However, the bases and sugars account for a larger fraction of the double helix potential with increasing distance. We have found that when the solvent is treated with the Debye-Huckel approximation, the potential decays more rapidly in every direction from the surface than it did in the concentric dielectric cylinder approximation.

  12. Approximation of optimal filter for Ornstein-Uhlenbeck process with quantised discrete-time observation

    NASA Astrophysics Data System (ADS)

    Bania, Piotr; Baranowski, Jerzy

    2018-02-01

    Quantisation of signals is a ubiquitous property of digital processing. In many cases, it introduces significant difficulties in state estimation and in consequence control. Popular approaches either do not address properly the problem of system disturbances or lead to biased estimates. Our intention was to find a method for state estimation for stochastic systems with quantised and discrete observation, that is free of the mentioned drawbacks. We have formulated a general form of the optimal filter derived by a solution of Fokker-Planck equation. We then propose the approximation method based on Galerkin projections. We illustrate the approach for the Ornstein-Uhlenbeck process, and derive analytic formulae for the approximated optimal filter, also extending the results for the variant with control. Operation is illustrated with numerical experiments and compared with classical discrete-continuous Kalman filter. Results of comparison are substantially in favour of our approach, with over 20 times lower mean squared error. The proposed filter is especially effective for signal amplitudes comparable to the quantisation thresholds. Additionally, it was observed that for high order of approximation, state estimate is very close to the true process value. The results open the possibilities of further analysis, especially for more complex processes.

  13. First and second order approximations to stage numbers in multicomponent enrichment cascades

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Scopatz, A.

    2013-07-01

    This paper describes closed form, Taylor series approximations to the number product stages in a multicomponent enrichment cascade. Such closed form approximations are required when a symbolic, rather than a numeric, algorithm is used to compute the optimal cascade state. Both first and second order approximations were implemented. The first order solution was found to be grossly incorrect, having the wrong functional form over the entire domain. On the other hand, the second order solution shows excellent agreement with the 'true' solution over the domain of interest. An implementation of the symbolic, second order solver is available in the freemore » and open source PyNE library. (authors)« less

  14. Fast computation of molecular random phase approximation correlation energies using resolution of the identity and imaginary frequency integration

    NASA Astrophysics Data System (ADS)

    Eshuis, Henk; Yarkony, Julian; Furche, Filipp

    2010-06-01

    The random phase approximation (RPA) is an increasingly popular post-Kohn-Sham correlation method, but its high computational cost has limited molecular applications to systems with few atoms. Here we present an efficient implementation of RPA correlation energies based on a combination of resolution of the identity (RI) and imaginary frequency integration techniques. We show that the RI approximation to four-index electron repulsion integrals leads to a variational upper bound to the exact RPA correlation energy if the Coulomb metric is used. Auxiliary basis sets optimized for second-order Møller-Plesset (MP2) calculations are well suitable for RPA, as is demonstrated for the HEAT [A. Tajti et al., J. Chem. Phys. 121, 11599 (2004)] and MOLEKEL [F. Weigend et al., Chem. Phys. Lett. 294, 143 (1998)] benchmark sets. Using imaginary frequency integration rather than diagonalization to compute the matrix square root necessary for RPA, evaluation of the RPA correlation energy requires O(N4 log N) operations and O(N3) storage only; the price for this dramatic improvement over existing algorithms is a numerical quadrature. We propose a numerical integration scheme that is exact in the two-orbital case and converges exponentially with the number of grid points. For most systems, 30-40 grid points yield μH accuracy in triple zeta basis sets, but much larger grids are necessary for small gap systems. The lowest-order approximation to the present method is a post-Kohn-Sham frequency-domain version of opposite-spin Laplace-transform RI-MP2 [J. Jung et al., Phys. Rev. B 70, 205107 (2004)]. Timings for polyacenes with up to 30 atoms show speed-ups of two orders of magnitude over previous implementations. The present approach makes it possible to routinely compute RPA correlation energies of systems well beyond 100 atoms, as is demonstrated for the octapeptide angiotensin II.

  15. Fast computation of molecular random phase approximation correlation energies using resolution of the identity and imaginary frequency integration.

    PubMed

    Eshuis, Henk; Yarkony, Julian; Furche, Filipp

    2010-06-21

    The random phase approximation (RPA) is an increasingly popular post-Kohn-Sham correlation method, but its high computational cost has limited molecular applications to systems with few atoms. Here we present an efficient implementation of RPA correlation energies based on a combination of resolution of the identity (RI) and imaginary frequency integration techniques. We show that the RI approximation to four-index electron repulsion integrals leads to a variational upper bound to the exact RPA correlation energy if the Coulomb metric is used. Auxiliary basis sets optimized for second-order Møller-Plesset (MP2) calculations are well suitable for RPA, as is demonstrated for the HEAT [A. Tajti et al., J. Chem. Phys. 121, 11599 (2004)] and MOLEKEL [F. Weigend et al., Chem. Phys. Lett. 294, 143 (1998)] benchmark sets. Using imaginary frequency integration rather than diagonalization to compute the matrix square root necessary for RPA, evaluation of the RPA correlation energy requires O(N(4) log N) operations and O(N(3)) storage only; the price for this dramatic improvement over existing algorithms is a numerical quadrature. We propose a numerical integration scheme that is exact in the two-orbital case and converges exponentially with the number of grid points. For most systems, 30-40 grid points yield muH accuracy in triple zeta basis sets, but much larger grids are necessary for small gap systems. The lowest-order approximation to the present method is a post-Kohn-Sham frequency-domain version of opposite-spin Laplace-transform RI-MP2 [J. Jung et al., Phys. Rev. B 70, 205107 (2004)]. Timings for polyacenes with up to 30 atoms show speed-ups of two orders of magnitude over previous implementations. The present approach makes it possible to routinely compute RPA correlation energies of systems well beyond 100 atoms, as is demonstrated for the octapeptide angiotensin II.

  16. Scalar production and decay to top quarks including interference effects at NLO in QCD in an EFT approach

    DOE PAGES

    Franzosi, Diogo Buarque; Vryonidou, Eleni; Zhang, Cen

    2017-10-13

    Scalar and pseudo-scalar resonances decaying to top quarks are common predictions in several scenarios beyond the standard model (SM) and are extensively searched for by LHC experiments. Challenges on the experimental side require optimising the strategy based on accurate predictions. Firstly, QCD corrections are known to be large both for the SM QCD background and for the pure signal scalar production. Secondly, leading order and approximate next-to-leading order (NLO) calculations indicate that the interference between signal and background is large and drastically changes the lineshape of the signal, from a simple peak to a peak-dip structure. Therefore, a robust predictionmore » of this interference at NLO accuracy in QCD is necessary to ensure that higher-order corrections do not alter the lineshapes. We compute the exact NLO corrections, assuming a point-like coupling between the scalar and the gluons and consistently embedding the calculation in an effective field theory within an automated framework, and present results for a representative set of beyond the SM benchmarks. The results can be further matched to parton shower simulation, providing more realistic predictions. We find that NLO corrections are important and lead to a significant reduction of the uncertainties. We also discuss how our computation can be used to improve the predictions for physics scenarios where the gluon-scalar loop is resolved and the effective approach is less applicable.« less

  17. Corner-corrected diagonal-norm summation-by-parts operators for the first derivative with increased order of accuracy

    NASA Astrophysics Data System (ADS)

    Del Rey Fernández, David C.; Boom, Pieter D.; Zingg, David W.

    2017-02-01

    Combined with simultaneous approximation terms, summation-by-parts (SBP) operators offer a versatile and efficient methodology that leads to consistent, conservative, and provably stable discretizations. However, diagonal-norm operators with a repeating interior-point operator that have thus far been constructed suffer from a loss of accuracy. While on the interior, these operators are of degree 2p, at a number of nodes near the boundaries, they are of degree p, and therefore of global degree p - meaning the highest degree monomial for which the operators are exact at all nodes. This implies that for hyperbolic problems and operators of degree greater than unity they lead to solutions with a global order of accuracy lower than the degree of the interior-point operator. In this paper, we develop a procedure to construct diagonal-norm first-derivative SBP operators that are of degree 2p at all nodes and therefore can lead to solutions of hyperbolic problems of order 2 p + 1. This is accomplished by adding nonzero entries in the upper-right and lower-left corners of SBP operator matrices with a repeating interior-point operator. This modification necessitates treating these new operators as elements, where mesh refinement is accomplished by increasing the number of elements in the mesh rather than increasing the number of nodes. The significant improvements in accuracy of this new family, for the same repeating interior-point operator, are demonstrated in the context of the linear convection equation.

  18. Scalar production and decay to top quarks including interference effects at NLO in QCD in an EFT approach

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Franzosi, Diogo Buarque; Vryonidou, Eleni; Zhang, Cen

    Scalar and pseudo-scalar resonances decaying to top quarks are common predictions in several scenarios beyond the standard model (SM) and are extensively searched for by LHC experiments. Challenges on the experimental side require optimising the strategy based on accurate predictions. Firstly, QCD corrections are known to be large both for the SM QCD background and for the pure signal scalar production. Secondly, leading order and approximate next-to-leading order (NLO) calculations indicate that the interference between signal and background is large and drastically changes the lineshape of the signal, from a simple peak to a peak-dip structure. Therefore, a robust predictionmore » of this interference at NLO accuracy in QCD is necessary to ensure that higher-order corrections do not alter the lineshapes. We compute the exact NLO corrections, assuming a point-like coupling between the scalar and the gluons and consistently embedding the calculation in an effective field theory within an automated framework, and present results for a representative set of beyond the SM benchmarks. The results can be further matched to parton shower simulation, providing more realistic predictions. We find that NLO corrections are important and lead to a significant reduction of the uncertainties. We also discuss how our computation can be used to improve the predictions for physics scenarios where the gluon-scalar loop is resolved and the effective approach is less applicable.« less

  19. A simple molecular orbital treatment of current distributions in quantum transport through molecular junctions

    NASA Astrophysics Data System (ADS)

    Jhan, Sin-Mu; Jin, Bih-Yaw

    2017-11-01

    A simple molecular orbital treatment of local current distributions inside single molecular junctions is developed in this paper. Using the first-order perturbation theory and nonequilibrium Green's function techniques in the framework of Hückel theory, we show that the leading contributions to local current distributions are directly proportional to the off-diagonal elements of transition density matrices. Under the orbital approximation, the major contributions to local currents come from a few dominant molecular orbital pairs which are mixed by the interactions between the molecule and electrodes. A few simple molecular junctions consisting of single- and multi-ring conjugated systems are used to demonstrate that local current distributions inside molecular junctions can be decomposed by partial sums of a few leading contributing transition density matrices.

  20. Introducing MCgrid 2.0: Projecting cross section calculations on grids

    NASA Astrophysics Data System (ADS)

    Bothmann, Enrico; Hartland, Nathan; Schumann, Steffen

    2015-11-01

    MCgrid is a software package that provides access to interpolation tools for Monte Carlo event generator codes, allowing for the fast and flexible variation of scales, coupling parameters and PDFs in cutting edge leading- and next-to-leading-order QCD calculations. We present the upgrade to version 2.0 which has a broader scope of interfaced interpolation tools, now providing access to fastNLO, and features an approximated treatment for the projection of MC@NLO-type calculations onto interpolation grids. MCgrid 2.0 also now supports the extended information provided through the HepMC event record used in the recent SHERPA version 2.2.0. The additional information provided therein allows for the support of multi-jet merged QCD calculations in a future update of MCgrid.

  1. Color Coherent Radiation in Multi - Jet Events from $$p\\overline{p}$$ Collisions at $$\\sqrt{s}$$ = 1.8-TeV

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Cullen-Vidal, David Edward

    1997-01-01

    Results from a study of color coherence phenomena in multi-jet events produced bymore » $$p\\overline{p}$$ collisions are presented. Approximately 13 $$pb^{-1}$$ of data were collected by the D0 detector during the 1992-1993 run of the Fermilab Tevatron $$p\\overline{p}$$ collider at a center of mass energy of $$\\sqrt{s}$$ = 1.8 TeV. Demonstration of initial-to-final state color interference effects is done by measuring spatial correlations between the softer third jet and the second leading-$$E_{\\tau}$$ jet in the events. The data are compared to several Monte Carlo simulations with different color coherence implementations and to the predictions of a Next-to-Leading Order parton level calculation.« less

  2. Modal expansions for infrasound propagation and their implications for ground-to-ground propagation.

    PubMed

    Waxler, Roger; Assink, Jelle; Velea, Doru

    2017-02-01

    The use of expansions in vertical eigenmodes for long range infrasound propagation modeling in the effective sound speed approximation is investigated. The question of convergence of such expansions is related to the maximum elevation angles that are required. Including atmospheric attenuation leads to a non-self-adjoint vertical eigenvalue problem. The use of leading order perturbation theory for the modal attenuation is compared to the results of numerical solutions to the non-self-adjoint eigenvalue problem and conditions under which the perturbative result is expected to be valid are obtained. Modal expansions are obtained in the frequency domain; broadband signals must be modeled through Fourier reconstruction. Such broadband signal reconstruction is investigated and the relation between bandwidth, wavetrain duration, and frequency sampling is discussed.

  3. Evaluation of four sampling methods for determining exposure of children to lead-contaminated household dust

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Sterling, D.A.; Roegner, K.C.; Lewis, R.D.

    Childhood exposure to lead has been demonstrated to result in health effects and lead-contaminated household dust is a primary exposure source. There is a need to establish reliable methods for sampling surfaces to determine levels of lead contamination. Three vacuums (HVS3, GS80, and MVM) and one wipe method were evaluated for the collection of household floor dust under field sampling conditions within a Superfund site and demographically similar control area. Side-by-side floor samples were taken from three locations within 41 randomly selected households between August and September 1995: a child's bedroom, primary play area, and primary entrance. Analysis was performedmore » to assess the relative collection performance of each sampler, spatial distribution of lead within a household, and correlation of lead loading with observed blood lead level, and to determine if discrete or composites samples were more predictive of blood lead levels. Approximately 90% of the floor surfaces were carpeted. The rank order of sampling methods from greatest to lowest collection efficiency was HVS3 > G80 > wipe > MVM. The HVS3 had the highest level of precision (CV = 0.05), with the GS80 and wipe precisions 0.48 and 0.053, respectively.« less

  4. Evaluating the effects of real power losses in optimal power flow based storage integration

    DOE PAGES

    Castillo, Anya; Gayme, Dennice

    2017-03-27

    This study proposes a DC optimal power flow (DCOPF) with losses formulation (the `-DCOPF+S problem) and uses it to investigate the role of real power losses in OPF based grid-scale storage integration. We derive the `- DCOPF+S problem by augmenting a standard DCOPF with storage (DCOPF+S) problem to include quadratic real power loss approximations. This procedure leads to a multi-period nonconvex quadratically constrained quadratic program, which we prove can be solved to optimality using either a semidefinite or second order cone relaxation. Our approach has some important benefits over existing models. It is more computationally tractable than ACOPF with storagemore » (ACOPF+S) formulations and the provably exact convex relaxations guarantee that an optimal solution can be attained for a feasible problem. Adding loss approximations to a DCOPF+S model leads to a more accurate representation of locational marginal prices, which have been shown to be critical to determining optimal storage dispatch and siting in prior ACOPF+S based studies. Case studies demonstrate the improved accuracy of the `-DCOPF+S model over a DCOPF+S model and the computational advantages over an ACOPF+S formulation.« less

  5. Approximation methods for control of structural acoustics models with piezoceramic actuators

    NASA Astrophysics Data System (ADS)

    Banks, H. T.; Fang, W.; Silcox, R. J.; Smith, R. C.

    1993-01-01

    The active control of acoustic pressure in a 2-D cavity with a flexible boundary (a beam) is considered. Specifically, this control is implemented via piezoceramic patches on the beam which produces pure bending moments. The incorporation of the feedback control in this manner leads to a system with an unbounded input term. Approximation methods in this manner leads to a system with an unbounded input term. Approximation methods in this manner leads to a system with an unbounded input team. Approximation methods in the context of linear quadratic regulator (LQR) state space control formulation are discussed and numerical results demonstrating the effectiveness of this approach in computing feedback controls for noise reduction are presented.

  6. The validity of flow approximations when simulating catchment-integrated flash floods

    NASA Astrophysics Data System (ADS)

    Bout, B.; Jetten, V. G.

    2018-01-01

    Within hydrological models, flow approximations are commonly used to reduce computation time. The validity of these approximations is strongly determined by flow height, flow velocity and the spatial resolution of the model. In this presentation, the validity and performance of the kinematic, diffusive and dynamic flow approximations are investigated for use in a catchment-based flood model. Particularly, the validity during flood events and for varying spatial resolutions is investigated. The OpenLISEM hydrological model is extended to implement both these flow approximations and channel flooding based on dynamic flow. The flow approximations are used to recreate measured discharge in three catchments, among which is the hydrograph of the 2003 flood event in the Fella river basin. Furthermore, spatial resolutions are varied for the flood simulation in order to investigate the influence of spatial resolution on these flow approximations. Results show that the kinematic, diffusive and dynamic flow approximation provide least to highest accuracy, respectively, in recreating measured discharge. Kinematic flow, which is commonly used in hydrological modelling, substantially over-estimates hydrological connectivity in the simulations with a spatial resolution of below 30 m. Since spatial resolutions of models have strongly increased over the past decades, usage of routed kinematic flow should be reconsidered. The combination of diffusive or dynamic overland flow and dynamic channel flooding provides high accuracy in recreating the 2003 Fella river flood event. Finally, in the case of flood events, spatial modelling of kinematic flow substantially over-estimates hydrological connectivity and flow concentration since pressure forces are removed, leading to significant errors.

  7. Deriving analytic solutions for compact binary inspirals without recourse to adiabatic approximations

    NASA Astrophysics Data System (ADS)

    Galley, Chad R.; Rothstein, Ira Z.

    2017-05-01

    We utilize the dynamical renormalization group formalism to calculate the real space trajectory of a compact binary inspiral for long times via a systematic resummation of secularly growing terms. This method generates closed form solutions without orbit averaging, and the accuracy can be systematically improved. The expansion parameter is v5ν Ω (t -t0) where t0 is the initial time, t is the time elapsed, and Ω and v are the angular orbital frequency and initial speed, respectively. ν is the binary's symmetric mass ratio. We demonstrate how to apply the renormalization group method to resum solutions beyond leading order in two ways. First, we calculate the second-order corrections of the leading radiation reaction force, which involves highly nontrivial checks of the formalism (i.e., its renormalizability). Second, we show how to systematically include post-Newtonian corrections to the radiation reaction force. By avoiding orbit averaging, we gain predictive power and eliminate ambiguities in the initial conditions. Finally, we discuss how this methodology can be used to find analytic solutions to the spin equations of motion that are valid over long times.

  8. Polynomial sequences for bond percolation critical thresholds

    DOE PAGES

    Scullard, Christian R.

    2011-09-22

    In this paper, I compute the inhomogeneous (multi-probability) bond critical surfaces for the (4, 6, 12) and (3 4, 6) using the linearity approximation described in (Scullard and Ziff, J. Stat. Mech. 03021), implemented as a branching process of lattices. I find the estimates for the bond percolation thresholds, pc(4, 6, 12) = 0.69377849... and p c(3 4, 6) = 0.43437077..., compared with Parviainen’s numerical results of p c = 0.69373383... and p c = 0.43430621... . These deviations are of the order 10 -5, as is standard for this method. Deriving thresholds in this way for a given latticemore » leads to a polynomial with integer coefficients, the root in [0, 1] of which gives the estimate for the bond threshold and I show how the method can be refined, leading to a series of higher order polynomials making predictions that likely converge to the exact answer. Finally, I discuss how this fact hints that for certain graphs, such as the kagome lattice, the exact bond threshold may not be the root of any polynomial with integer coefficients.« less

  9. Extraction of quark transversity distribution and Collins fragmentation functions with QCD evolution

    NASA Astrophysics Data System (ADS)

    Kang, Zhong-Bo; Prokudin, Alexei; Sun, Peng; Yuan, Feng

    2016-01-01

    We study the transverse-momentum-dependent (TMD) evolution of the Collins azimuthal asymmetries in e+e- annihilations and semi-inclusive hadron production in deep inelastic scattering processes. All the relevant coefficients are calculated up to the next-to-leading-logarithmic-order accuracy. By applying the TMD evolution at the approximate next-to-leading-logarithmic order in the Collins-Soper-Sterman formalism, we extract transversity distributions for u and d quarks and Collins fragmentation functions from current experimental data by a global analysis of the Collins asymmetries in back-to-back dihadron productions in e+e- annihilations measured by BELLE and BABAR collaborations and semi-inclusive hadron production in deep inelastic scattering data from HERMES, COMPASS, and JLab HALL A experiments. The impact of the evolution effects and the relevant theoretical uncertainties are discussed. We further discuss the TMD interpretation for our results and illustrate the unpolarized quark distribution, transversity distribution, unpolarized quark fragmentation, and Collins fragmentation functions depending on the transverse momentum and the hard momentum scale. We make detailed predictions for future experiments and discuss their impact.

  10. Finite-dimensional approximation for optimal fixed-order compensation of distributed parameter systems

    NASA Technical Reports Server (NTRS)

    Bernstein, Dennis S.; Rosen, I. G.

    1988-01-01

    In controlling distributed parameter systems it is often desirable to obtain low-order, finite-dimensional controllers in order to minimize real-time computational requirements. Standard approaches to this problem employ model/controller reduction techniques in conjunction with LQG theory. In this paper we consider the finite-dimensional approximation of the infinite-dimensional Bernstein/Hyland optimal projection theory. This approach yields fixed-finite-order controllers which are optimal with respect to high-order, approximating, finite-dimensional plant models. The technique is illustrated by computing a sequence of first-order controllers for one-dimensional, single-input/single-output, parabolic (heat/diffusion) and hereditary systems using spline-based, Ritz-Galerkin, finite element approximation. Numerical studies indicate convergence of the feedback gains with less than 2 percent performance degradation over full-order LQG controllers for the parabolic system and 10 percent degradation for the hereditary system.

  11. Measurement of the $$b\\bar{b}$$ di-jet cross section at CDF

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Vallecorsa, Sofia

    The dominant b production mechanism at the Tevatron is pair production through strong interactions. The lowest order QCD diagrams contain only b andmore » $$\\bar{b}$$ quarks in the final state, for which momentum conservation requires the quarks to be produced back-to-back in azimuthal opening angle. When higher order QCD processes are considered, the presence of additional light quarks and gluons in the final state allows the azimuthal angle difference, Δφ, to spread. The next to leading order QCD calculation includes diagrams up to O(α$$3\\atop{s}$$) some of which, commonly known as flavor excitation and gluon splitting, provide a contribution of approximately the same magnitude as the lowest order diagrams. The study of b$$\\bar{b}$$ angular correlation gives predictions on the effective b quark production mechanisms and on the different contributions of the leading order and next-to-leading order terms. The first experimental results on inclusive bottom production at the Tevatron were strongly underestimated by the exact NLO QCD prediction. Later on this disagreement had been explained and reduced by theoretical and experimental improvements: new QCD calculations that implement the Fixed Order with Next-to- Leading-Logarithms calculation (FONLL); updated parton distribution functions and fragmentation functions; and more precise measurements. Previous measurements of b$$\\bar{b}$$ azimuthal angle correlation have, instead, reached various level of agreement with parton shower Monte Carlo and NLO predictions. Here we present a measurement of the b$$\\bar{b}$$ jet cross section and azimuthal angle correlation performed on about 260 pb -1 of data collected by the CDF II detector at Fermilab from March 2002 to September 2004. This study extends the energy range investigated by previous analyses, measuring jet transverse energies (E T) up to values of about 220 GeV. It relies on the good tracking capabilities of the CDF detector both at the trigger level and offline. Events with heavy quarks are selected online using the Secondary Vertex Trigger (SVT), which can measure in real time the impact parameter of the tracks, in particular those originated from the decay of long-lived particles. The SVT represents the key element for all the heavy flavor measurement performed by CDF, and this analysis describes one of the first cases in which the SVT trigger is used to study high pT physics. The total cross section is mesured together with the di-jet differential cross sections as a function of the highest energy jet ET and the di-jet invariant mass. The azimuthal angular correlation (Δφ) between the two jets is also measured. As expected this distribution proves that the largest contribution to b$$\\bar{b}$$ production is due to lowest order QCD diagrams, corresponding to a back to back configuration of the two b-jets (large Δφ values). The most interesting fact is, however, that the low Δφ region also results highly populated, suggesting an important role played by higher order production terms. To verify this conclusion, results are compared to Monte Carlo predictions at leading order and next to leading order QCD. When technical details are correctly taken into account, as the contribution of the underlying event for example, it is possible to conclude that the data are in agreement with a next to leading order model. Nevertheless the agreement is not perfect and the data present some excess with respect to theoretical predictions. This thesis describes the analysis steps in details as support to the PRL paper forseen to be published soon.« less

  12. Accurate upwind methods for the Euler equations

    NASA Technical Reports Server (NTRS)

    Huynh, Hung T.

    1993-01-01

    A new class of piecewise linear methods for the numerical solution of the one-dimensional Euler equations of gas dynamics is presented. These methods are uniformly second-order accurate, and can be considered as extensions of Godunov's scheme. With an appropriate definition of monotonicity preservation for the case of linear convection, it can be shown that they preserve monotonicity. Similar to Van Leer's MUSCL scheme, they consist of two key steps: a reconstruction step followed by an upwind step. For the reconstruction step, a monotonicity constraint that preserves uniform second-order accuracy is introduced. Computational efficiency is enhanced by devising a criterion that detects the 'smooth' part of the data where the constraint is redundant. The concept and coding of the constraint are simplified by the use of the median function. A slope steepening technique, which has no effect at smooth regions and can resolve a contact discontinuity in four cells, is described. As for the upwind step, existing and new methods are applied in a manner slightly different from those in the literature. These methods are derived by approximating the Euler equations via linearization and diagonalization. At a 'smooth' interface, Harten, Lax, and Van Leer's one intermediate state model is employed. A modification for this model that can resolve contact discontinuities is presented. Near a discontinuity, either this modified model or a more accurate one, namely, Roe's flux-difference splitting. is used. The current presentation of Roe's method, via the conceptually simple flux-vector splitting, not only establishes a connection between the two splittings, but also leads to an admissibility correction with no conditional statement, and an efficient approximation to Osher's approximate Riemann solver. These reconstruction and upwind steps result in schemes that are uniformly second-order accurate and economical at smooth regions, and yield high resolution at discontinuities.

  13. Advancing age produces sex differences in vasomotor kinetics during and after skeletal muscle contraction.

    PubMed

    Bearden, Shawn E

    2007-09-01

    Little is known of the vasomotor responses of skeletal muscle arterioles during and following muscle contraction. We hypothesized that aging leads to impaired arteriolar responses to muscle contraction and recovery. Nitric oxide (NO) availability, which is age dependent, has been implicated in components of these kinetics. Therefore, we also hypothesized that changes in the kinetics of vascular responses are associated with the NO pathway. Groups were young (3 mo), old (24 mo), endothelial NO synthase knockout (eNOS-/-), and N(G)-nitro-L-arginine (L-NA)-treated male and female C57BL/6 mice. The kinetics of vasodilation during and following 1 min of contractions of the gluteus maximus muscle were recorded in second-order (regional distribution) and third-order (local control) arterioles. Baseline, peak (during contraction), and maximal diameters (pharmacological) were not affected by age or sex. The kinetics of dilation and recovery were not different between males and females at the young age. There was a significant slowing of vasodilation at the onset of contractions (approximately 2-fold; P < 0.05) and a significant speeding of recovery ( approximately 5-fold; P < 0.05) in old males vs. old females and vs. young eNOS-/-, and L-NA did not affect the kinetics at the onset of muscle contraction. eNOS-/- mimicked the rapid recovery of old males in second-order arterioles; acute NO production (L-NA) explained approximately 50% of this effect. These data demonstrate fundamental age-related differences between the sexes in the dynamic function of skeletal muscle arterioles. Understanding how youthful function persists in females but not males may provide therapeutic insight into clinical interventions to maintain dynamic microvascular control of nutrient supply with age.

  14. Lead poisoning in a 16-year-old girl: a case report and a review of the literature (CARE compliant).

    PubMed

    Mărginean, Cristina Oana; Meliţ, Lorena Elena; Moldovan, Horaţiu; Lupu, Vasile Valeriu; Mărginean, Maria Oana

    2016-09-01

    Lead is a toxic element of the environment which leads to major complications once it enters the blood stream, affecting multiple organs and systems of the body. We present the case of a 16-year-old girl, diagnosed with lead poisoning after occupational exposure due to the fact that the girl was actively involved in the family's pottery business.History revealed that the girl participated in the process of pottery, her father was also diagnosed with lead poisoning 2 years before. The patient's personal history underlined that approximately 1 year ago she presented with severe abdominal pain, being diagnosed with acute appendicitis and she underwent appendectomy, but the pain persisted, thus due to family history of lead poisoning, the suspicion of saturnine colic rose, and she was diagnosed with lead poisoning. The main symptoms and signs were severe abdominal pain, vomiting, and arterial hypertension. The clinical evolution was favorable under symptomatic treatment and chelation therapy. Lead toxicity is a life-threatening condition because of its severe acute and chronic complications. In children, there is no safe blood lead level, prevention methods are, therefore, very important in order to avoid toxic multiorganic effects of this metal. Even though the diagnosis of lead poisoning remains difficult in children, it must also be taken into consideration by the clinician facing a child with gastrointestinal or neurological involvement.

  15. Communication: Accurate higher-order van der Waals coefficients between molecules from a model dynamic multipole polarizability

    DOE PAGES

    Tao, Jianmin; Rappe, Andrew M.

    2016-01-20

    Due to the absence of the long-range van der Waals (vdW) interaction, conventional density functional theory (DFT) often fails in the description of molecular complexes and solids. In recent years, considerable progress has been made in the development of the vdW correction. However, the vdW correction based on the leading-order coefficient C 6 alone can only achieve limited accuracy, while accurate modeling of higher-order coefficients remains a formidable task, due to the strong non-additivity effect. Here, we apply a model dynamic multipole polarizability within a modified single-frequency approximation to calculate C 8 and C 10 between small molecules. We findmore » that the higher-order vdW coefficients from this model can achieve remarkable accuracy, with mean absolute relative deviations of 5% for C 8 and 7% for C 10. As a result, inclusion of accurate higher-order contributions in the vdW correction will effectively enhance the predictive power of DFT in condensed matter physics and quantum chemistry.« less

  16. Arrhenius Rate: constant volume burn

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Menikoff, Ralph

    A constant volume burn occurs for an idealized initial state in which a large volume of reactants at rest is suddenly raised to a high temperature and begins to burn. Due to the uniform spatial state, there is no fluid motion and no heat conduction. This reduces the time evolu tion to an ODE for the reaction progress variable. With an Arrhenius reaction rate, two characteristics of thermal ignition are illustrated: induction time and thermal runaway. The Frank-Kamenetskii approximation then leads to a simple expression for the adiabatic induction time. For a first order reaction, the analytic solution is derivedmore » and used to illustrate the effect of varying the activation temperature; in particular, on the induction time. In general, the ODE can be solved numerically. This is used to illustrate the effect of varying the reaction order. We note that for a first order reaction, the time evolution of the reaction progress variable has an exponential tail. In contrast, for a reaction order less than one, the reaction completes in a nite time. The reaction order also affects the induction time.« less

  17. The interaction between a propagating coastal vortex and topographic waves

    NASA Astrophysics Data System (ADS)

    Parry, Simon Wyn

    This thesis investigates the motion of a point vortex near coastal topography in a rotating frame of reference at constant latitude (f-plane) in the linear and weakly nonlinear limits. Topography is considered in the form of an infinitely long escarpment running parallel to a wall. The vortex motion and topographic waves are governed by the conservation of quasi-geostrophic potential vorticity in shallow water, from which a nonlinear system of equations is derived. First the linear limit is studied for three cases; a weak vortex on- and off-shelf and a weak vortex close to the wall. For the first two cases it is shown that to leading order the vortex motion is stationary and a solution for the topographic waves at the escarpment can be found in terms of Fourier integrals. For a weak vortex close to a wall, the leading order solution is a steadily propagating vortex with a topographic wavetrain at the step. Numerical results for the higher order interactions are also presented and explained in terms of conservation of momentum in the along-shore direction. For the second case a resonant interaction between the vortex and the waves occurs when the vortex speed is equal to the maximum group velocity of the waves and the linear response becomes unbounded at large times. Thus it becomes necessary to examine the weakly nonlinear near-resonant case. Using a long wave approximation a nonlinear evolution equation for the interface separating the two regions of differing relative potential vorticity is derived and has similar form to the BDA (Benjamin, Davies, Acrivos 1967) equation. Results for the leading order steadily propagating vortex and for the vortex-wave feedback problem are calculated numerically using spectral multi-step Adams methods.

  18. Disordered λ φ4+ρ φ6 Landau-Ginzburg model

    NASA Astrophysics Data System (ADS)

    Diaz, R. Acosta; Svaiter, N. F.; Krein, G.; Zarro, C. A. D.

    2018-03-01

    We discuss a disordered λ φ4+ρ φ6 Landau-Ginzburg model defined in a d -dimensional space. First we adopt the standard procedure of averaging the disorder-dependent free energy of the model. The dominant contribution to this quantity is represented by a series of the replica partition functions of the system. Next, using the replica-symmetry ansatz in the saddle-point equations, we prove that the average free energy represents a system with multiple ground states with different order parameters. For low temperatures we show the presence of metastable equilibrium states for some replica fields for a range of values of the physical parameters. Finally, going beyond the mean-field approximation, the one-loop renormalization of this model is performed, in the leading-order replica partition function.

  19. Two-peak structure in the K-edge RIXS spectra of a spatially frustrated Heisenberg antiferromagnet

    NASA Astrophysics Data System (ADS)

    Datta, Trinanjan; Luo, Cheng; Yao, Dao-Xin

    2014-03-01

    Quantum fluctuations due to spatial anisotropy and strong magnetic frustration lead to the formation of a two-peak structure in the K-edge bimagnon RIXS intensity spectra of a Jx-Jy-J2 Heisenberg model on a square lattice. We compute the RIXS intensity, including up to first order 1/S spin wave expansion correction, using the Bethe-Salpeter equation within the ladder approximation scheme. The two-peak feature occurs in both the antiferromagnetic phase and the collinear antiferromagnetic phase. A knowledge of the peak splitting energy from both magnetically ordered regime can provide experimentalists with an alternative means to measure and study the effects of local microscopic exchange constants. Cottrell Research Corporation, NSFC-11074310, NSFC-11275279, Specialized Research Fund for the Doctoral Program of Higher Education.

  20. Dissecting cross-impact on stock markets: an empirical analysis

    NASA Astrophysics Data System (ADS)

    Benzaquen, M.; Mastromatteo, I.; Eisler, Z.; Bouchaud, J.-P.

    2017-02-01

    The vast majority of market impact studies assess each product individually, and the interactions between the different order flows are disregarded. This strong approximation may lead to an underestimation of trading costs and possible contagion effects. Transactions in fact mediate a significant part of the correlation between different instruments. In turn, liquidity shares the sectorial structure of market correlations, which can be encoded as a set of eigenvalues and eigenvectors. We introduce a multivariate linear propagator model that successfully describes such a structure, and accounts for a significant fraction of the covariance of stock returns. We dissect the various dynamical mechanisms that contribute to the joint dynamics of assets. We also define two simplified models with substantially less parameters in order to reduce overfitting, and show that they have superior out-of-sample performance.

  1. Empirical study on social groups in pedestrian evacuation dynamics

    NASA Astrophysics Data System (ADS)

    von Krüchten, Cornelia; Schadschneider, Andreas

    2017-06-01

    Pedestrian crowds often include social groups, i.e. pedestrians that walk together because of social relationships. They show characteristic configurations and influence the dynamics of the entire crowd. In order to investigate the impact of social groups on evacuations we performed an empirical study with pupils. Several evacuation runs with groups of different sizes and different interactions were performed. New group parameters are introduced which allow to describe the dynamics of the groups and the configuration of the group members quantitatively. The analysis shows a possible decrease of evacuation times for large groups due to self-ordering effects. Social groups can be approximated as ellipses that orientate along their direction of motion. Furthermore, explicitly cooperative behaviour among group members leads to a stronger aggregation of group members and an intermittent way of evacuation.

  2. Theory of the Effects of Small Gravitational Levels on Droplet Gasification

    NASA Technical Reports Server (NTRS)

    Beitelmal, A.; Shaw, B. D.

    1995-01-01

    A mathematical model taking into account small (and constant) gravitational levels is developed for vaporization of an isolated liquid droplet suspended in a stagnant atmosphere. A goal of the present analysis is to see how small gravitational levels affect droplet gasification characteristics. Attention is focused upon determining the effects on gas-phase phenomena. The conservation equations arc normalized and nondimensionalized, and a small parameter that accounts for the effects of gravity is identified. This parameter is the square of the inverse of a Froude number based on the gravitational acceleration, the droplet radius, and a characteristic gas-phase velocity at the droplet surface. Asymptotic analyses are developed in terms of this parameter. In the analyses, different spatial regions are identified. Near a droplet, gravitational effects are negligible in the first approximation, and the flowfield is spherically symmetric to the leading order. Analysis shows, however, that outer zones exist where gravitational effects cannot be neglected; it is expected that a stagnation point will be present in an outer zone that is not present when gravity is totally absent. The leading order and higher-order differential equations for each zone are derived and solved. The solutions allow the effects of gravity on vaporization rates and temperature, velocity and species fields to be determined.

  3. A Hybrid Strategy for the Lattice Evaluation of the Leading Order Hadronic Contribution to (g - 2)μ

    NASA Astrophysics Data System (ADS)

    Golterman, Maarten; Maltman, Kim; Peris, Santiago

    2016-04-01

    The leading-order hadronic contribution to the muon anomalous magentic moment, aμLO,HVP, can be expressed as an integral over Euclidean Q2 of the vacuum polarization function. We point out that a simple trapezoid-rule numerical integration of the current lattice data is good enough to produce a result with a less-than-1% error for the contribution from the interval above Q2 ≳ 0.1 - 0.2GeV2. This leaves the interval below this value of Q2 as the one to focus on in the future. In order to achieve an accurate result also in this lower window Q2 ≲ 0.1 - 0.2GeV2, we indicate the usefulness of three possible tools. These are: Padé Approximants, polynomials in a conformal variable and a NNLO Chiral Perturbation Theory representation supplemented by a Q4 term. The combination of the numerical integration in the upper Q2 interval together with the use of these tools in the lower Q2 interval provides a hybrid strategy which looks promising as a means of reaching the desired goal on the lattice of a sub-percent precision in the hadronic vacuum polarization contribution to the muon anomalous magnetic moment.

  4. A comparison of zero-order, first-order, and monod biotransformation models

    USGS Publications Warehouse

    Bekins, B.A.; Warren, E.; Godsy, E.M.

    1998-01-01

    Under some conditions, a first-order kinetic model is a poor representation of biodegradation in contaminated aquifers. Although it is well known that the assumption of first-order kinetics is valid only when substrate concentration, S, is much less than the half-saturation constant, K(s), this assumption is often made without verification of this condition. We present a formal error analysis showing that the relative error in the first-order approximation is S/K(S) and in the zero-order approximation the error is K(s)/S. We then examine the problems that arise when the first-order approximation is used outside the range for which it is valid. A series of numerical simulations comparing results of first- and zero-order rate approximations to Monod kinetics for a real data set illustrates that if concentrations observed in the field are higher than K(s), it may better to model degradation using a zero-order rate expression. Compared with Monod kinetics, extrapolation of a first-order rate to lower concentrations under-predicts the biotransformation potential, while extrapolation to higher concentrations may grossly over-predict the transformation rate. A summary of solubilities and Monod parameters for aerobic benzene, toluene, and xylene (BTX) degradation shows that the a priori assumption of first-order degradation kinetics at sites contaminated with these compounds is not valid. In particular, out of six published values of KS for toluene, only one is greater than 2 mg/L, indicating that when toluene is present in concentrations greater than about a part per million, the assumption of first-order kinetics may be invalid. Finally, we apply an existing analytical solution for steady-state one-dimensional advective transport with Monod degradation kinetics to a field data set.A formal error analysis is presented showing that the relative error in the first-order approximation is S/KS and in the zero-order approximation the error is KS/S where S is the substrate concentration and KS is the half-saturation constant. The problems that arise when the first-order approximation is used outside the range for which it is valid are examined. A series of numerical simulations comparing results of first- and zero-order rate approximations to Monod kinetics for a real data set illustrates that if concentrations observed in the field are higher than KS, it may be better to model degradation using a zero-order rate expression.

  5. Observation Impacts for Longer Forecast Lead-Times

    NASA Astrophysics Data System (ADS)

    Mahajan, R.; Gelaro, R.; Todling, R.

    2013-12-01

    Observation impact on forecasts evaluated using adjoint-based techniques (e.g. Langland and Baker, 2004) are limited by the validity of the assumptions underlying the forecasting model adjoint. Most applications of this approach have focused on deriving observation impacts on short-range forecasts (e.g. 24-hour) in part to stay well within linearization assumptions. The most widely used measure of observation impact relies on the availability of the analysis for verifying the forecasts. As pointed out by Gelaro et al. (2007), and more recently by Todling (2013), this introduces undesirable correlations in the measure that are likely to affect the resulting assessment of the observing system. Stappers and Barkmeijer (2012) introduced a technique that, in principle, allows extending the validity of tangent linear and corresponding adjoint models to longer lead-times, thereby reducing the correlations in the measures used for observation impact assessments. The methodology provides the means to better represent linearized models by making use of Gaussian quadrature relations to handle various underlying non-linear model trajectories. The formulation is exact for particular bi-linear dynamics; it corresponds to an approximation for general-type nonlinearities and must be tested for large atmospheric models. The present work investigates the approach of Stappers and Barkmeijer (2012)in the context of NASA's Goddard Earth Observing System Version 5 (GEOS-5) atmospheric data assimilation system (ADAS). The goal is to calculate observation impacts in the GEOS-5 ADAS for forecast lead-times of at least 48 hours in order to reduce the potential for undesirable correlations that occur at shorter forecast lead times. References [1]Langland, R. H., and N. L. Baker, 2004: Estimation of observation impact using the NRL atmospheric variational data assimilation adjoint system. Tellus, 56A, 189-201. [2] Gelaro, R., Y. Zhu, and R. M. Errico, 2007: Examination of various-order adjoint-based approximations of observation impact. Meteoroloische Zeitschrift, 16, 685-692. [3]Stappers, R. J. J., and J. Barkmeijer, 2012: Optimal linearization trajectories for tangent linear models. Q. J. R. Meteorol. Soc., 138, 170-184. [4] Todling, R. 2013: Comparing two approaches for assessing observation impact. Mon. Wea. Rev., 141, 1484-1505.

  6. The dynamics of current carriers in standing Alfvén waves: Parallel electric fields in the auroral acceleration region

    NASA Astrophysics Data System (ADS)

    Wright, Andrew N.; Allan, W.; Ruderman, Michael S.; Elphic, R. C.

    2002-07-01

    The acceleration of current carriers in an Alfvén wave current system is considered. The model incorporates a dipole magnetic field geometry, and we present an analytical solution of the two-fluid equations by successive approximations. The leading solution corresponds to the familiar single-fluid toroidal oscillations. The next order describes the nonlinear dynamics of electrons responsible for carrying a few μAm-2 field aligned current into the ionosphere. The solution shows how most of the electron acceleration in the magnetosphere occurs within 1 RE of the ionosphere, and that a parallel electric field of the order of 1 mVm-1 is responsible for energising the electrons to 1 keV. The limitations of the electron fluid approximation are considered, and a qualitative solution including electron beams and a modified E∥ is developed in accord with observations. We find that the electron acceleration can be nonlinear, (ve∥∇∥)ve∥ > ωve∥, as a result of our nonuniform equilibrium field geometry even when ve∥ is less than the Alfvén speed. Our calculation also elucidates the processes through which E∥ is generated and supported.

  7. Theoretical Investigation of Anharmonic Effects Observed in the Infrared Spectra of the Formaldehyde Cation and its Hydroxymethylene Isomer

    NASA Astrophysics Data System (ADS)

    Madison, Lindsey R.; Mosley, Jonathan; Mauney, Daniel; Duncan, Michael A.; McCoy, Anne B.

    2016-06-01

    Formaldehyde is the smallest organic molecule and is a prime candidate for a thorough investigation regarding the anharmonic approximations made in computationally modeling its infrared spectrum. Mass-selected ion spectroscopy was used to detect mass 30 cations which include of HCOH^+ and CH_2O^+. In order to elucidate the differences between the structures of these isomers, infrared spectroscopy was performed on the mass 30 cations using Ar predissociation. Interestingly, several additional spectral features are observed that cannot be explained by the fundamental OH and CH stretch vibrations alone. By including anharmonic coupling between OH and CH stretching and various overtones and combination bands involving lower frequency vibrations, we are able to identify how specific modes couple and lead to the experimentally observed spectral features. We combine straight-forward, ab initio calculations of the anharmonic frequencies of the mass 30 cations with higher order, adiabatic approximations and Fermi resonance models. By including anharmonic effects we are able to confirm that the isomers of the CH_2O^+\\cdotAr system have substantially different, and thus distinguishable, IR spectra and that many of the features can only be explained with anharmonic treatments.

  8. Can an unbroken flavour symmetry provide an approximate description of lepton masses and mixing?

    NASA Astrophysics Data System (ADS)

    Reyimuaji, Y.; Romanino, A.

    2018-03-01

    We provide a complete answer to the following question: what are the flavour groups and representations providing, in the symmetric limit, an approximate description of lepton masses and mixings? We assume that neutrino masses are described by the Weinberg operator. We show that the pattern of lepton masses and mixings only depends on the dimension, type (real, pseudoreal, complex), and equivalence of the irreducible components of the flavour representation, and we find only six viable cases. In all cases the neutrinos are either anarchical or have an inverted hierarchical spectrum. In the context of SU(5) unification, only the anarchical option is allowed. Therefore, if the hint of a normal hierarchical spectrum were confirmed, we would conclude (under the above assumption) that symmetry breaking effects must play a leading order role in the understanding of neutrino flavour observables. In order to obtain the above results, we develop a simple algorithm to determine the form of the lepton masses and mixings directly from the structure of the decomposition of the flavour representation in irreducible components, without the need to specify the form of the lepton mass matrices.

  9. Many-body effects and ultraviolet renormalization in three-dimensional Dirac materials

    NASA Astrophysics Data System (ADS)

    Throckmorton, Robert E.; Hofmann, Johannes; Barnes, Edwin; Das Sarma, S.

    2015-09-01

    We develop a theory for electron-electron interaction-induced many-body effects in three-dimensional Weyl or Dirac semimetals, including interaction corrections to the polarizability, electron self-energy, and vertex function, up to second order in the effective fine-structure constant of the Dirac material. These results are used to derive the higher-order ultraviolet renormalization of the Fermi velocity, effective coupling, and quasiparticle residue, revealing that the corrections to the renormalization group flows of both the velocity and coupling counteract the leading-order tendencies of velocity enhancement and coupling suppression at low energies. This in turn leads to the emergence of a critical coupling above which the interaction strength grows with decreasing energy scale. In addition, we identify a range of coupling strengths below the critical point in which the Fermi velocity varies nonmonotonically as the low-energy, noninteracting fixed point is approached. Furthermore, we find that while the higher-order correction to the flow of the coupling is generally small compared to the leading order, the corresponding correction to the velocity flow carries an additional factor of the Dirac cone flavor number (the multiplicity of electron species, e.g. ground-state valley degeneracy arising from the band structure) relative to the leading-order result. Thus, for materials with a larger multiplicity, the regime of velocity nonmonotonicity is reached for modest values of the coupling strength. This is in stark contrast to an approach based on a large-N expansion or the random phase approximation (RPA), where higher-order corrections are strongly suppressed for larger values of the Dirac cone multiplicity. This suggests that perturbation theory in the coupling constant (i.e., the loop expansion) and the RPA/large-N expansion are complementary in the sense that they are applicable in different parameter regimes of the theory. We show how our results for the ultraviolet renormalization of quasiparticle properties can be tested experimentally through measurements of quantities such as the optical conductivity or dielectric function (with carrier density or temperature acting as the scale being varied to induce the running coupling). Although experiments typically access the finite-density regime, we show that our zero-density results still capture clear many-body signatures that should be visible at higher temperatures even in real systems with disorder and finite doping.

  10. Efficient time-dependent density functional theory approximations for hybrid density functionals: analytical gradients and parallelization.

    PubMed

    Petrenko, Taras; Kossmann, Simone; Neese, Frank

    2011-02-07

    In this paper, we present the implementation of efficient approximations to time-dependent density functional theory (TDDFT) within the Tamm-Dancoff approximation (TDA) for hybrid density functionals. For the calculation of the TDDFT/TDA excitation energies and analytical gradients, we combine the resolution of identity (RI-J) algorithm for the computation of the Coulomb terms and the recently introduced "chain of spheres exchange" (COSX) algorithm for the calculation of the exchange terms. It is shown that for extended basis sets, the RIJCOSX approximation leads to speedups of up to 2 orders of magnitude compared to traditional methods, as demonstrated for hydrocarbon chains. The accuracy of the adiabatic transition energies, excited state structures, and vibrational frequencies is assessed on a set of 27 excited states for 25 molecules with the configuration interaction singles and hybrid TDDFT/TDA methods using various basis sets. Compared to the canonical values, the typical error in transition energies is of the order of 0.01 eV. Similar to the ground-state results, excited state equilibrium geometries differ by less than 0.3 pm in the bond distances and 0.5° in the bond angles from the canonical values. The typical error in the calculated excited state normal coordinate displacements is of the order of 0.01, and relative error in the calculated excited state vibrational frequencies is less than 1%. The errors introduced by the RIJCOSX approximation are, thus, insignificant compared to the errors related to the approximate nature of the TDDFT methods and basis set truncation. For TDDFT/TDA energy and gradient calculations on Ag-TB2-helicate (156 atoms, 2732 basis functions), it is demonstrated that the COSX algorithm parallelizes almost perfectly (speedup ~26-29 for 30 processors). The exchange-correlation terms also parallelize well (speedup ~27-29 for 30 processors). The solution of the Z-vector equations shows a speedup of ~24 on 30 processors. The parallelization efficiency for the Coulomb terms can be somewhat smaller (speedup ~15-25 for 30 processors), but their contribution to the total calculation time is small. Thus, the parallel program completes a Becke3-Lee-Yang-Parr energy and gradient calculation on the Ag-TB2-helicate in less than 4 h on 30 processors. We also present the necessary extension of the Lagrangian formalism, which enables the calculation of the TDDFT excited state properties in the frozen-core approximation. The algorithms described in this work are implemented into the ORCA electronic structure system.

  11. Homogenization of one-dimensional draining through heterogeneous porous media including higher-order approximations

    NASA Astrophysics Data System (ADS)

    Anderson, Daniel M.; McLaughlin, Richard M.; Miller, Cass T.

    2018-02-01

    We examine a mathematical model of one-dimensional draining of a fluid through a periodically-layered porous medium. A porous medium, initially saturated with a fluid of a high density is assumed to drain out the bottom of the porous medium with a second lighter fluid replacing the draining fluid. We assume that the draining layer is sufficiently dense that the dynamics of the lighter fluid can be neglected with respect to the dynamics of the heavier draining fluid and that the height of the draining fluid, represented as a free boundary in the model, evolves in time. In this context, we neglect interfacial tension effects at the boundary between the two fluids. We show that this problem admits an exact solution. Our primary objective is to develop a homogenization theory in which we find not only leading-order, or effective, trends but also capture higher-order corrections to these effective draining rates. The approximate solution obtained by this homogenization theory is compared to the exact solution for two cases: (1) the permeability of the porous medium varies smoothly but rapidly and (2) the permeability varies as a piecewise constant function representing discrete layers of alternating high/low permeability. In both cases we are able to show that the corrections in the homogenization theory accurately predict the position of the free boundary moving through the porous medium.

  12. An Expansion Formula with Higher-Order Derivatives for Fractional Operators of Variable Order

    PubMed Central

    Almeida, Ricardo

    2013-01-01

    We obtain approximation formulas for fractional integrals and derivatives of Riemann-Liouville and Marchaud types with a variable fractional order. The approximations involve integer-order derivatives only. An estimation for the error is given. The efficiency of the approximation method is illustrated with examples. As applications, we show how the obtained results are useful to solve differential equations, and problems of the calculus of variations that depend on fractional derivatives of Marchaud type. PMID:24319382

  13. Asymptotic safety of quantum gravity beyond Ricci scalars

    NASA Astrophysics Data System (ADS)

    Falls, Kevin; King, Callum R.; Litim, Daniel F.; Nikolakopoulos, Kostas; Rahmede, Christoph

    2018-04-01

    We investigate the asymptotic safety conjecture for quantum gravity including curvature invariants beyond Ricci scalars. Our strategy is put to work for families of gravitational actions which depend on functions of the Ricci scalar, the Ricci tensor, and products thereof. Combining functional renormalization with high order polynomial approximations and full numerical integration we derive the renormalization group flow for all couplings and analyse their fixed points, scaling exponents, and the fixed point effective action as a function of the background Ricci curvature. The theory is characterized by three relevant couplings. Higher-dimensional couplings show near-Gaussian scaling with increasing canonical mass dimension. We find that Ricci tensor invariants stabilize the UV fixed point and lead to a rapid convergence of polynomial approximations. We apply our results to models for cosmology and establish that the gravitational fixed point admits inflationary solutions. We also compare findings with those from f (R ) -type theories in the same approximation and pin-point the key new effects due to Ricci tensor interactions. Implications for the asymptotic safety conjecture of gravity are indicated.

  14. Local error estimates for discontinuous solutions of nonlinear hyperbolic equations

    NASA Technical Reports Server (NTRS)

    Tadmor, Eitan

    1989-01-01

    Let u(x,t) be the possibly discontinuous entropy solution of a nonlinear scalar conservation law with smooth initial data. Suppose u sub epsilon(x,t) is the solution of an approximate viscosity regularization, where epsilon greater than 0 is the small viscosity amplitude. It is shown that by post-processing the small viscosity approximation u sub epsilon, pointwise values of u and its derivatives can be recovered with an error as close to epsilon as desired. The analysis relies on the adjoint problem of the forward error equation, which in this case amounts to a backward linear transport with discontinuous coefficients. The novelty of this approach is to use a (generalized) E-condition of the forward problem in order to deduce a W(exp 1,infinity) energy estimate for the discontinuous backward transport equation; this, in turn, leads one to an epsilon-uniform estimate on moments of the error u(sub epsilon) - u. This approach does not follow the characteristics and, therefore, applies mutatis mutandis to other approximate solutions such as E-difference schemes.

  15. Seabird guano is an efficient conveyer of persistent organic pollutants (POPs) to Arctic lake ecosystems.

    PubMed

    Evenset, A; Carroll, J; Christensen, G N; Kallenborn, R; Gregor, D; Gabrielsen, G W

    2007-02-15

    Migratory seabirds have been linked to localized "hotspots" of contamination in remote Arctic lakes. One of these lakes is Lake Ellasjøen on Bjørnøya in the Barents Sea. Here we provide quantitative evidence demonstrating that even relatively small populations of certain seabird species can lead to major impacts for ecosystems. In the present example, seabird guano accounts for approximately 14% of the contaminant inventory of the Lake Ellasjøen catchment area, approximately 80% of the contaminant inventory of the lake itself, and is approximately thirty times more efficient as a contaminant transport pathway compared to atmospheric long-range transport. We have further shown that this biological transport mechanism is an important contaminant exposure route for ecosystems, responsible for POPs levels in freshwater fish that are an order of magnitude higher than those in Arctic top predators. Given the worldwide presence of seabird colonies in coastal marine areas where resources are also harvested by humans, this biological transport pathway may be a greater source of dietary contamination than is currently recognized with consequent risks for human health.

  16. Forming the First Stars in the Universe: The Fragmentation of Primordial Gas.

    PubMed

    Bromm; Coppi; Larson

    1999-12-10

    In order to constrain the initial mass function of the first generation of stars (Population III), we investigate the fragmentation properties of metal-free gas in the context of a hierarchical model of structure formation. We investigate the evolution of an isolated 3 sigma peak of mass 2x106 M middle dot in circle that collapses at zcoll approximately 30 using smoothed particle hydrodynamics. We find that the gas dissipatively settles into a rotationally supported disk that has a very filamentary morphology. The gas in these filaments is Jeans unstable with MJ approximately 103 M middle dot in circle. Fragmentation leads to the formation of high-density (n>108 cm-3) clumps that subsequently grow in mass by accreting the surrounding gas and by merging with other clumps up to masses of approximately 104 M middle dot in circle. This suggests that the very first stars were rather massive. We explore the complex dynamics of the merging and tidal disruption of these clumps by following their evolution over a few dynamical times.

  17. Lead isotope ratios for bullets, a descriptive approach for investigative purposes and a new method for sampling of bullet lead.

    PubMed

    Sjåstad, Knut-Endre; Simonsen, Siri Lene; Andersen, Tom H

    2014-11-01

    To establish a link between a bullet fired from a suspected firearm, investigation of striation marks are one of the corner stones in the forensic laboratory. Nevertheless, on some occasions, the bullet may be deformed to such extent that traditional investigation of striation marks will be impossible. Fragments of lead can be investigated by lead isotope ratio determination in order to distinguish between bullets with different origin. This approach initially seems reasonable, since the abundance of lead isotopes varies significantly in nature. To make a method valid for forensic purposes, it is important to have a fundamental understanding of the variation within a box of lead bullets and the expected variation between boxes. Studies of variability within and between boxes of ammunition are imperative to perform any type of forensic interpretation, both in an investigative and evaluative context. This work presents an extensive study of variability within and between boxes of ammunition by use of multicollector inductive coupled mass spectrometry. As a first approximation to classify bullets to any given source, a simple and robust graphical method is presented. In addition, an easy-to-use sampling procedure of lead is presented. Copyright © 2014 Elsevier Ireland Ltd. All rights reserved.

  18. Many-body theory of electrical, thermal and optical response of molecular heterojunctions

    NASA Astrophysics Data System (ADS)

    Bergfield, Justin Phillip

    In this work, we develop a many-body theory of electronic transport through single molecule junctions based on nonequilibrium Green's functions (NEGFs). The central quantity of this theory is the Coulomb self-energy matrix of the junction SigmaC. SigmaC is evaluated exactly in the sequential-tunneling limit, and the correction due to finite lead-molecule tunneling is evaluated using a conserving approximation based on diagrammatic perturbation theory on the Keldysh contour. In this way, tunneling processes are included to infinite order, meaning that any approximation utilized is a truncation in the physical processes considered rather than in the order of those processes. Our theory reproduces the key features of both the Coulomb blockade and coherent transport regimes simultaneously in a single unified theory. Nonperturbative effects of intramolecular correlations are included, which are necessary to accurately describe the highest occupied molecular orbital (HOMO)-lowest unoccupied molecular orbital (LUMO) gap, essential for a quantitative theory of transport. This work covers four major topics related to transport in single-molecule junctions. First, we use our many-body theory to calculate the nonlinear electrical response of the archetypal Au-1,4-benzenedithiol-Au junction and find irregularly shaped 'molecular diamonds' which have been experimentally observed in some larger molecules but which are inaccessible to existing theoretical approaches. Next, we extend our theory to include heat transport and develop an exact expression for the heat current in an interacting nanostructure. Using this result, we discover that quantum coherence can strongly enhance the thermoelectric response of a device, a result with a number of technological applications. We then develop the formalism to include multi-orbital lead-molecule contacts and multi-channel leads, both of which strongly affect the observable transport. Lastly, we include a dynamic screening correction to Sigma C and investigate the optoelectric response of several molecular junctions.

  19. Collapse and Fragmentation of Molecular Cloud Cores. VII. Magnetic Fields and Multiple Protostar Formation

    NASA Astrophysics Data System (ADS)

    Boss, Alan P.

    2002-04-01

    Recent observations of star-forming regions suggest that binary and multiple young stars are the rule rather than the exception and implicate fragmentation as the likely mechanism for their formation. Most numerical hydrodynamic calculations of fragmentation have neglected the possibly deleterious effects of magnetic fields, despite ample evidence for the importance of magnetic support of precollapse clouds. We present here the first numerical hydrodynamic survey of the collapse and fragmentation of initially magnetically supported clouds that takes into account several magnetic field effects in an approximate manner. The models are calculated with a three-dimensional, finite differences code that solves the equations of hydrodynamics, gravitation, and radiative transfer in the Eddington and diffusion approximations. Magnetic field effects are included through two simple approximations: magnetic pressure is added to the gas pressure, and magnetic tension is approximated by gravity dilution once collapse is well underway. Ambipolar diffusion of the magnetic field leading to cloud collapse is treated approximately as well. Models are calculated for a variety of initial cloud density profiles, shapes, and rotation rates. We find that in spite of the inclusion of magnetic field effects, dense cloud cores are capable of fragmenting into binary and multiple protostar systems. Initially prolate clouds tend to fragment into binary protostars, while initially oblate clouds tend to fragment into multiple protostar systems containing a small number (of the order of 4) of fragments. The latter are likely to be subject to rapid orbital evolution, with close encounters possibly leading to the ejection of fragments. Contrary to expectation, magnetic tension effects appear to enhance fragmentation, allowing lower mass fragments to form than would otherwise be possible, because magnetic tension helps to prevent a central density singularity from forming and producing a dominant single object. Magnetically supported dense cloud cores thus seem to be capable of collapsing and fragmenting into sufficient numbers of binary and multiple protostar systems to be compatible with observations of the relative rarity of single protostars.

  20. A 300 year history of lead contamination in northern French Alps reconstructed from distant lake sediment records.

    PubMed

    Arnaud, F; Revel-Rolland, M; Bosch, D; Winiarski, T; Desmet, M; Tribovillard, N; Givelet, N

    2004-05-01

    Lead concentrations and isotopic ratios were measured along two well-dated sediment cores from two distant lakes: Anterne (2100 m a.s.l.) and Le Bourget (270 m a.s.l.), submitted to low and high direct human impact and covering the last 250 and 600 years, respectively. The measurement of lead in old sediment samples (>3000 BP) permits, in using mixing-models, the determination of lead concentration, flux and isotopic composition of purely anthropogenic origin. We thus show that since ca. 1800 AD the regional increase in lead contamination was mostly driven by coal consumption ((206)Pb/(207)Pb approximately 1.17-1.19; (206)Pb/(204)Pb approximately 18.3-18.6), which peaks around 1915 AD. The increasing usage of leaded gasoline, introduced in the 1920s, was recorded in both lakes by increasing Pb concentrations and decreasing Pb isotope ratios. A peak around 1970 ((206)Pb/(207)Pb approximately 1.13-1.16; (206)Pb/(204)Pb approximately 17.6-18.0) corresponds to the worldwide recorded leaded gasoline maximum of consumption. The 1973 oil crisis is characterised by a drastic drop of lead fluxes in both lakes (from approximately 35 to <20 mg cm(-2) yr(-1)). In the late 1980s, environmental policies made the Lake Anterne flux drop to pre-1900 values (<10 mg cm(-2) yr(-1)) while Lake Le Bourget is always submitted to an important flux (approximately 25 mg cm(-2) yr(-1)). The good match of our distant records, together and with a previously established series in an ice core from Mont Blanc, provides confidence in the use of sediments as archives of lead contamination. The integration of the Mont Blanc ice core results from Rosman et al. with our data highlights, from 1990 onward, a decoupling in lead sources between the high elevation sites (Lake Anterne and Mont Blanc ice core), submitted to a mixture of long-distance and regional contamination and the low elevation site (Lake Le Bourget), where regional contamination is predominant.

  1. Second-order singular pertubative theory for gravitational lenses

    NASA Astrophysics Data System (ADS)

    Alard, C.

    2018-03-01

    The extension of the singular perturbative approach to the second order is presented in this paper. The general expansion to the second order is derived. The second-order expansion is considered as a small correction to the first-order expansion. Using this approach, it is demonstrated that in practice the second-order expansion is reducible to a first order expansion via a re-definition of the first-order pertubative fields. Even if in usual applications the second-order correction is small the reducibility of the second-order expansion to the first-order expansion indicates a potential degeneracy issue. In general, this degeneracy is hard to break. A useful and simple second-order approximation is the thin source approximation, which offers a direct estimation of the correction. The practical application of the corrections derived in this paper is illustrated by using an elliptical NFW lens model. The second-order pertubative expansion provides a noticeable improvement, even for the simplest case of thin source approximation. To conclude, it is clear that for accurate modelization of gravitational lenses using the perturbative method the second-order perturbative expansion should be considered. In particular, an evaluation of the degeneracy due to the second-order term should be performed, for which the thin source approximation is particularly useful.

  2. Structural Reliability Analysis and Optimization: Use of Approximations

    NASA Technical Reports Server (NTRS)

    Grandhi, Ramana V.; Wang, Liping

    1999-01-01

    This report is intended for the demonstration of function approximation concepts and their applicability in reliability analysis and design. Particularly, approximations in the calculation of the safety index, failure probability and structural optimization (modification of design variables) are developed. With this scope in mind, extensive details on probability theory are avoided. Definitions relevant to the stated objectives have been taken from standard text books. The idea of function approximations is to minimize the repetitive use of computationally intensive calculations by replacing them with simpler closed-form equations, which could be nonlinear. Typically, the approximations provide good accuracy around the points where they are constructed, and they need to be periodically updated to extend their utility. There are approximations in calculating the failure probability of a limit state function. The first one, which is most commonly discussed, is how the limit state is approximated at the design point. Most of the time this could be a first-order Taylor series expansion, also known as the First Order Reliability Method (FORM), or a second-order Taylor series expansion (paraboloid), also known as the Second Order Reliability Method (SORM). From the computational procedure point of view, this step comes after the design point identification; however, the order of approximation for the probability of failure calculation is discussed first, and it is denoted by either FORM or SORM. The other approximation of interest is how the design point, or the most probable failure point (MPP), is identified. For iteratively finding this point, again the limit state is approximated. The accuracy and efficiency of the approximations make the search process quite practical for analysis intensive approaches such as the finite element methods; therefore, the crux of this research is to develop excellent approximations for MPP identification and also different approximations including the higher-order reliability methods (HORM) for representing the failure surface. This report is divided into several parts to emphasize different segments of the structural reliability analysis and design. Broadly, it consists of mathematical foundations, methods and applications. Chapter I discusses the fundamental definitions of the probability theory, which are mostly available in standard text books. Probability density function descriptions relevant to this work are addressed. In Chapter 2, the concept and utility of function approximation are discussed for a general application in engineering analysis. Various forms of function representations and the latest developments in nonlinear adaptive approximations are presented with comparison studies. Research work accomplished in reliability analysis is presented in Chapter 3. First, the definition of safety index and most probable point of failure are introduced. Efficient ways of computing the safety index with a fewer number of iterations is emphasized. In chapter 4, the probability of failure prediction is presented using first-order, second-order and higher-order methods. System reliability methods are discussed in chapter 5. Chapter 6 presents optimization techniques for the modification and redistribution of structural sizes for improving the structural reliability. The report also contains several appendices on probability parameters.

  3. Study of X(5568) in a unitary coupled-channel approximation of BK¯ and Bs π

    NASA Astrophysics Data System (ADS)

    Sun, Bao-Xi; Dong, Fang-Yong; Pang, Jing-Long

    2017-07-01

    The potential of the B meson and the pseudoscalar meson is constructed up to the next-to-leading order Lagrangian, and then the BK¯ and Bs π interaction is studied in the unitary coupled-channel approximation. A resonant state with a mass about 5568 MeV and JP =0+ is generated dynamically, which can be associated with the X(5568) state announced by the D0 Collaboration recently. The mass and the decay width of this resonant state depend on the regularization scale in the dimensional regularization scheme, or the maximum momentum in the momentum cutoff regularization scheme. The scattering amplitude of the vector B meson and the pseudoscalar meson is calculated, and an axial-vector state with a mass near 5620 MeV and JP =1+ is produced. Their partners in the charm sector are also discussed.

  4. Cryosurgery Planning Using Bubble Packing in 3D

    PubMed Central

    Tanaka, Daigo; Shimada, Kenji; Rossi, Michael R.; Rabin, Yoed

    2008-01-01

    As part of an ongoing project to develop automated tools for cryosurgery planning, the current study focuses on the development of a 3D bubble packing method. A proof-of-concept for the new method is demonstrated on five prostate models, reconstructed from ultrasound images. The new method is a modification of an established method in 2D. Ellipsoidal bubbles are packed in the volume of the prostate in the current study; such bubbles can be viewed as a first-order approximation of a frozen region around a single cryoprobe. When all cryoprobes are inserted to the same depth, optimum planning was found to occur at about 60% of the length of the prostate (measured from its apex), which leads to cooling of approximately 75% of the prostate volume below a specific temperature threshold of −22°C. Bubble packing has the potential to dramatically reduce the run time for automated planning. PMID:17963095

  5. Cryosurgery planning using bubble packing in 3D.

    PubMed

    Tanaka, Daigo; Shimada, Kenji; Rossi, Michael R; Rabin, Yoed

    2008-04-01

    As part of an ongoing project to develop automated tools for cryosurgery planning, the current study focuses on the development of a 3D bubble packing method. A proof-of-concept for the new method is demonstrated on five prostate models, reconstructed from ultrasound images. The new method is a modification of an established method in 2D. Ellipsoidal bubbles are packed in the volume of the prostate in the current study; such bubbles can be viewed as a first-order approximation of a frozen region around a single cryoprobe. When all cryoprobes are inserted to the same depth, optimum planning was found to occur at about 60% of the length of the prostate (measured from its apex), which leads to cooling of approximately 75% of the prostate volume below a specific temperature threshold of - 22 degrees C. Bubble packing has the potential to dramatically reduce the run time for automated planning.

  6. Radiative transfer equation accounting for rotational Raman scattering and its solution by the discrete-ordinates method

    NASA Astrophysics Data System (ADS)

    Rozanov, Vladimir V.; Vountas, Marco

    2014-01-01

    Rotational Raman scattering of solar light in Earth's atmosphere leads to the filling-in of Fraunhofer and telluric lines observed in the reflected spectrum. The phenomenological derivation of the inelastic radiative transfer equation including rotational Raman scattering is presented. The different forms of the approximate radiative transfer equation with first-order rotational Raman scattering terms are obtained employing the Cabannes, Rayleigh, and Cabannes-Rayleigh scattering models. The solution of these equations is considered in the framework of the discrete-ordinates method using rigorous and approximate approaches to derive particular integrals. An alternative forward-adjoint technique is suggested as well. A detailed description of the model including the exact spectral matching and a binning scheme that significantly speeds up the calculations is given. The considered solution techniques are implemented in the radiative transfer software package SCIATRAN and a specified benchmark setup is presented to enable readers to compare with own results transparently.

  7. SEE rate estimation based on diffusion approximation of charge collection

    NASA Astrophysics Data System (ADS)

    Sogoyan, Armen V.; Chumakov, Alexander I.; Smolin, Anatoly A.

    2018-03-01

    The integral rectangular parallelepiped (IRPP) method remains the main approach to single event rate (SER) prediction for aerospace systems, despite the growing number of issues impairing method's validity when applied to scaled technology nodes. One of such issues is uncertainty in parameters extraction in the IRPP method, which can lead to a spread of several orders of magnitude in the subsequently calculated SER. The paper presents an alternative approach to SER estimation based on diffusion approximation of the charge collection by an IC element and geometrical interpretation of SEE cross-section. In contrast to the IRPP method, the proposed model includes only two parameters which are uniquely determined from the experimental data for normal incidence irradiation at an ion accelerator. This approach eliminates the necessity of arbitrary decisions during parameter extraction and, thus, greatly simplifies calculation procedure and increases the robustness of the forecast.

  8. Rayleigh-Sommerfield Diffraction vs Fresnel-Kirchhoff, Fourier Propagation and Poisson's Spot

    NASA Technical Reports Server (NTRS)

    Lucke, Robert L.

    2004-01-01

    The boundary conditions imposed on the diffraction problem in order to obtain the Fresnel-Kirchhoff (FK) solution are well-known to be mathematically inconsistent and to be violated by the solution when the observation point is close to the diffracting screen 1-3. These problems are absent in the Rayleigh-Sommerfeld (RS) solution. The difference between RS and FK is in the inclination factor and is usually immaterial because the inclination factor is approximated by unity. But when this approximation is not valid, FK can lead to unacceptable answers. Calculating the on-axis intensity of Poisson s spot provides a critical test, a test passed by RS and failed by FK. FK fails because (a) convergence of the integral depends on how it is evaluated and (b) when the convergence problem is xed, the predicted amplitude at points near the obscuring disk is not consistent with the assumed boundary conditions.

  9. Pion distribution amplitude from lattice QCD.

    PubMed

    Cloët, I C; Chang, L; Roberts, C D; Schmidt, S M; Tandy, P C

    2013-08-30

    A method is explained through which a pointwise accurate approximation to the pion's valence-quark distribution amplitude (PDA) may be obtained from a limited number of moments. In connection with the single nontrivial moment accessible in contemporary simulations of lattice-regularized QCD, the method yields a PDA that is a broad concave function whose pointwise form agrees with that predicted by Dyson-Schwinger equation analyses of the pion. Under leading-order evolution, the PDA remains broad to energy scales in excess of 100 GeV, a feature which signals persistence of the influence of dynamical chiral symmetry breaking. Consequently, the asymptotic distribution φπ(asy)(x) is a poor approximation to the pion's PDA at all such scales that are either currently accessible or foreseeable in experiments on pion elastic and transition form factors. Thus, related expectations based on φ φπ(asy)(x) should be revised.

  10. Simulated Reentry Heating by Torching

    NASA Technical Reports Server (NTRS)

    Harvey, Gale A.

    2008-01-01

    The two first order reentry heating parameters are peak heating flux (W/cm2) and peak heat load (kJ/cm2). Peak heating flux (and deceleration, gs) is higher for a ballistic reentry and peak heat load is higher for a lifting reentry. Manned vehicle reentries are generally lifting reentries at nominal 1-5 gs so that personnel will not be crushed by high deceleration force. A few off-nominal manned reentries have experienced 8 or more gs with corresponding high heating flux (but below nominal heat load). The Shuttle Orbiter reentries provide about an order of magnitude difference in peak heating flux at mid-bottom (TPS tiles, approximately 6 W/cm2 or 5 BTU/ft2- sec) and leading edge (RCC, approximately 60 W/cm2 or 50 BTU/ft2- sec). Orion lunar return and Mars sample lander are of the same order of magnitude as orbiter leading edge peak heat loads. Flight temperature measurements are available for some orbiter TPS tile and RCC locations. Return-to-Flight on-orbit tile-repair-candidate-material-heating performance was evaluated by matching propane torch heating of candidate-materials temperatures at several depths to orbiter TPS tile flight-temperatures. Char and ash characteristics, heat expansion, and temperature histories at several depths of the cure-in-place ablator were some of the TPS repair material performance characteristics measured. The final char surface was above the initial surface for the primary candidate (silicone based) material, in contrast to a receded surface for the Apollo-type ablative heat shield material. Candidate TPS materials for Orion CEV (LEO and lunar return), and for Mars sample lander are now being evaluated. Torching of a candidate ablator material, PICA, was performed to match the ablation experienced by the STARDUST PICA heat shield. Torching showed that the carbon fiberform skeleton in a sample of PICA was inhomogeneous in that sample, and allowed measurements (of the clumps and voids) of the inhomogeneity. Additional reentry heating-performance characterizations of high temperature insulation materials were performed.

  11. Elevation leads to altruistic behavior.

    PubMed

    Schnall, Simone; Roper, Jean; Fessler, Daniel M T

    2010-03-01

    Feelings of elevation, elicited by witnessing another person perform a good deed, have been hypothesized to motivate a desire to help others. However, despite growing interest in the determinants of prosocial behavior, there is only limited evidence that elevation leads to increases in altruistic behavior. In two experiments, we tested the relationship between elevation and helping behavior. Prior to measuring helping behavior, we measured elevation among participants in an elevation-inducing condition and control conditions in order to determine whether witnessing altruistic behavior elicited elevation. In Experiment 1, participants experiencing elevation were more likely to volunteer for a subsequent unpaid study than were participants in a neutral state. In Experiment 2, participants experiencing elevation spent approximately twice as long helping the experimenter with a tedious task as participants experiencing mirth or a neutral emotional state. Further, feelings of elevation, but not feelings of amusement or happiness, predicted the amount of helping. Together, these results provide evidence that witnessing another person's altruistic behavior elicits elevation, a discrete emotion that, in turn, leads to tangible increases in altruism.

  12. Gravitational corrections to light propagation in a perturbed FLRW universe and corresponding weak-lensing spectra

    NASA Astrophysics Data System (ADS)

    Cuesta-Lazaro, Carolina; Quera-Bofarull, Arnau; Reischke, Robert; Schäfer, Björn Malte

    2018-06-01

    When the gravitational lensing of the large-scale structure is calculated from a cosmological model a few assumptions enter: (i) one assumes that the photons follow unperturbed background geodesics, which is usually referred to as the Born approximation, (ii) the lenses move slowly, (iii) the source-redshift distribution is evaluated relative to the background quantities, and (iv) the lensing effect is linear in the gravitational potential. Even though these approximations are small individually they could sum up, especially since they include local effects such as the Sachs-Wolfe and peculiar motion, but also non-local ones like the Born approximation and the integrated Sachs-Wolfe effect. In this work, we will address all points mentioned and perturbatively calculate the effect on a tomographic cosmic shear power spectrum of each effect individually as well as all cross-correlations. Our findings show that each effect is at least 4-5 orders of magnitude below the leading order lensing signal. Finally, we sum up all effects to estimate the overall impact on parameter estimation by a future cosmological weak-lensing survey such as Euclid in a wcold dark matter cosmology with parametrization Ωm, σ8, ns, h, w0, and wa, using five tomographic bins. We consistently find a parameter bias of 10-5, which is therefore completely negligible for all practical purposes, confirming that other effects such as intrinsic alignments, magnification bias and uncertainties in the redshift distribution will be the dominant systematic source in future surveys.

  13. Overcoming computational uncertainties to reveal chemical sensitivity in single molecule conduction calculations.

    PubMed

    Solomon, Gemma C; Reimers, Jeffrey R; Hush, Noel S

    2005-06-08

    In the calculation of conduction through single molecule's approximations about the geometry and electronic structure of the system are usually made in order to simplify the problem. Previously [G. C. Solomon, J. R. Reimers, and N. S. Hush, J. Chem. Phys. 121, 6615 (2004)], we have shown that, in calculations employing cluster models for the electrodes, proper treatment of the open-shell nature of the clusters is the most important computational feature required to make the results sensitive to variations in the structural and chemical features of the system. Here, we expand this and establish a general hierarchy of requirements involving treatment of geometrical approximations. These approximations are categorized into two classes: those associated with finite-dimensional methods for representing the semi-infinite electrodes, and those associated with the chemisorption topology. We show that ca. 100 unique atoms are required in order to properly characterize each electrode: using fewer atoms leads to nonsystematic variations in conductivity that can overwhelm the subtler changes. The choice of binding site is shown to be the next most important feature, while some effects that are difficult to control experimentally concerning the orientations at each binding site are actually shown to be insignificant. Verification of this result provides a general test for the precision of computational procedures for molecular conductivity. Predictions concerning the dependence of conduction on substituent and other effects on the central molecule are found to be meaningful only when they exceed the uncertainties of the effects associated with binding-site variation.

  14. Overcoming computational uncertainties to reveal chemical sensitivity in single molecule conduction calculations

    NASA Astrophysics Data System (ADS)

    Solomon, Gemma C.; Reimers, Jeffrey R.; Hush, Noel S.

    2005-06-01

    In the calculation of conduction through single molecule's approximations about the geometry and electronic structure of the system are usually made in order to simplify the problem. Previously [G. C. Solomon, J. R. Reimers, and N. S. Hush, J. Chem. Phys. 121, 6615 (2004)], we have shown that, in calculations employing cluster models for the electrodes, proper treatment of the open-shell nature of the clusters is the most important computational feature required to make the results sensitive to variations in the structural and chemical features of the system. Here, we expand this and establish a general hierarchy of requirements involving treatment of geometrical approximations. These approximations are categorized into two classes: those associated with finite-dimensional methods for representing the semi-infinite electrodes, and those associated with the chemisorption topology. We show that ca. 100 unique atoms are required in order to properly characterize each electrode: using fewer atoms leads to nonsystematic variations in conductivity that can overwhelm the subtler changes. The choice of binding site is shown to be the next most important feature, while some effects that are difficult to control experimentally concerning the orientations at each binding site are actually shown to be insignificant. Verification of this result provides a general test for the precision of computational procedures for molecular conductivity. Predictions concerning the dependence of conduction on substituent and other effects on the central molecule are found to be meaningful only when they exceed the uncertainties of the effects associated with binding-site variation.

  15. A unified stochastic formulation of dissipative quantum dynamics. II. Beyond linear response of spin baths

    NASA Astrophysics Data System (ADS)

    Hsieh, Chang-Yu; Cao, Jianshu

    2018-01-01

    We use the "generalized hierarchical equation of motion" proposed in Paper I [C.-Y. Hsieh and J. Cao, J. Chem. Phys. 148, 014103 (2018)] to study decoherence in a system coupled to a spin bath. The present methodology allows a systematic incorporation of higher-order anharmonic effects of the bath in dynamical calculations. We investigate the leading order corrections to the linear response approximations for spin bath models. Two kinds of spin-based environments are considered: (1) a bath of spins discretized from a continuous spectral density and (2) a bath of localized nuclear or electron spins. The main difference resides with how the bath frequency and the system-bath coupling parameters are distributed in an environment. When discretized from a continuous spectral density, the system-bath coupling typically scales as ˜1 /√{NB } where NB is the number of bath spins. This scaling suppresses the non-Gaussian characteristics of the spin bath and justifies the linear response approximations in the thermodynamic limit. For the nuclear/electron spin bath models, system-bath couplings are directly deduced from spin-spin interactions and do not necessarily obey the 1 /√{NB } scaling. It is not always possible to justify the linear response approximations in this case. Furthermore, if the spin-spin Hamiltonian is highly symmetrical, there exist additional constraints that generate highly non-Markovian and persistent dynamics that is beyond the linear response treatments.

  16. Combination of the pair density approximation and the Takahashi–Imada approximation for path integral Monte Carlo simulations

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Zillich, Robert E., E-mail: robert.zillich@jku.at

    2015-11-15

    We construct an accurate imaginary time propagator for path integral Monte Carlo simulations for heterogeneous systems consisting of a mixture of atoms and molecules. We combine the pair density approximation, which is highly accurate but feasible only for the isotropic interactions between atoms, with the Takahashi–Imada approximation for general interactions. We present finite temperature simulations results for energy and structure of molecules–helium clusters X{sup 4}He{sub 20} (X=HCCH and LiH) which show a marked improvement over the Trotter approximation which has a 2nd-order time step bias. We show that the 4th-order corrections of the Takahashi–Imada approximation can also be applied perturbativelymore » to a 2nd-order simulation.« less

  17. Non-Markovian optimal sideband cooling

    NASA Astrophysics Data System (ADS)

    Triana, Johan F.; Pachon, Leonardo A.

    2018-04-01

    Optimal control theory is applied to sideband cooling of nano-mechanical resonators. The formulation described here makes use of exact results derived by means of the path-integral approach of quantum dynamics, so that no approximation is invoked. It is demonstrated that the intricate interplay between time-dependent fields and structured thermal bath may lead to improve results of the sideband cooling by an order of magnitude. Cooling is quantified by means of the mean number of phonons of the mechanical modes as well as by the von Neumann entropy. Potencial extension to non-linear systems, by means of semiclassical methods, is briefly discussed.

  18. Lattice relaxation in oxide heterostructures: LaTiO3/SrTiO3 superlattices.

    PubMed

    Okamoto, Satoshi; Millis, Andrew J; Spaldin, Nicola A

    2006-08-04

    Local density approximation + Hubbard U and many-body effective Hamiltonian calculations are used to determine the effects of lattice relaxation in LaTiO3/SrTiO3 superlattices. Large ferroelectric-like distortions of the TiO6 octahedra are found, which substantially affect the Ti d-electron density, bringing the calculated results into good agreement with experimental data. The relaxations also change the many-body physics, leading to a novel symmetry-breaking-induced ordering of the xy orbitals, which does not occur in bulk LaTiO3, or in the hypothetical unrelaxed structure.

  19. Theoretical characteristics of two-dimensional supersonic control surfaces

    NASA Technical Reports Server (NTRS)

    Morrissette, Robert R; Oborny, Lester F

    1951-01-01

    The "Busemann second-order-approximation theory" for the pressure distribution over a two-dimensional airfoil in supersonic flow was used to determine some of the aerodynamic characteristics of uncambered symmetrical parabolic and double-wedge airfoils with leading-edge and trailing-edge flaps. The characteristics presented and discussed in this paper are: flap effectiveness factor, rate of change of hinge-moment coefficient with flap deflection, rate of change of the pitching-moment coefficient with flap deflection, rate of change of the pitching-moment coefficient about the mid chord with flap deflection, and the location of the center of pressure of the airfoil-flap combination.

  20. The footwear factory's assembly sector: opposing organizational structure and quality from the ergonomic work analysis.

    PubMed

    Silva, Kláudia M M N; Coelho, Bernardo G P; Junior, Josemir V S; Faria, Luiz F M; Dutra, Ludmila; Alvarenga, Marília; Roggini, Renan; Echternach, Eliza Helena de Oliveira

    2012-01-01

    Data from 2006 indicated that Brazilian footwear leather industry was composed of approximately 9,488 formally registered establishments, considering the leather industry, footwear and leather goods. It was responsible for 211,582 people employed. However, in spite of having many employees, this kind of organization found several problems when analyzed from the ergonomics view. With this premise, then, in order to identify bottlenecks and other engineering problems that could cause discomfort and motivation lack among workers, leading directly to the loss of the product quality, the assembly sector of women's shoes factory was characterized.

  1. Wide band cryogenic ultra-high vacuum microwave absorber

    DOEpatents

    Campisi, I.E.

    1992-05-12

    An absorber waveguide assembly for absorbing higher order modes of microwave energy under cryogenic ultra-high vacuum conditions, that absorbs wide-band multi-mode energy. The absorber is of a special triangular shape, made from flat tiles of silicon carbide and aluminum nitride. The leading sharp end of the absorber is located in a corner of the waveguide and tapers to a larger cross-sectional area whose center is located approximately in the center of the wave guide. The absorber is relatively short, being of less height than the maximum width of the waveguide. 11 figs.

  2. Wide band cryogenic ultra-high vacuum microwave absorber

    DOEpatents

    Campisi, Isidoro E.

    1992-01-01

    An absorber wave guide assembly for absorbing higher order modes of microwave energy under cryogenic ultra-high vacuum conditions, that absorbs wide-band multi-mode energy. The absorber is of a special triangular shape, made from flat tiles of silicon carbide and aluminum nitride. The leading sharp end of the absorber is located in a corner of the wave guide and tapers to a larger cross-sectional area whose center is located approximately in the center of the wave guide. The absorber is relatively short, being of less height than the maximum width of the wave guide.

  3. Effective Hamiltonian approach to the Kerr nonlinearity in an optomechanical system

    NASA Astrophysics Data System (ADS)

    Gong, Z. R.; Ian, H.; Liu, Yu-Xi; Sun, C. P.; Nori, Franco

    2009-12-01

    Using the Born-Oppenheimer approximation, we derive an effective Hamiltonian for an optomechanical system that leads to a nonlinear Kerr effect in the system’s vacuum. The oscillating mirror at one edge of the optomechanical system induces a squeezing effect in the intensity spectrum of the cavity field. A near-resonant laser field is applied at the other edge to drive the cavity field in order to enhance the Kerr effect. We also propose a quantum-nondemolition-measurement setup to monitor a system with two cavities separated by a common oscillating mirror based on our effective Hamiltonian approach.

  4. On substructuring algorithms and solution techniques for the numerical approximation of partial differential equations

    NASA Technical Reports Server (NTRS)

    Gunzburger, M. D.; Nicolaides, R. A.

    1986-01-01

    Substructuring methods are in common use in mechanics problems where typically the associated linear systems of algebraic equations are positive definite. Here these methods are extended to problems which lead to nonpositive definite, nonsymmetric matrices. The extension is based on an algorithm which carries out the block Gauss elimination procedure without the need for interchanges even when a pivot matrix is singular. Examples are provided wherein the method is used in connection with finite element solutions of the stationary Stokes equations and the Helmholtz equation, and dual methods for second-order elliptic equations.

  5. Iapetus: unique surface properties and a global color dichotomy from Cassini imaging.

    PubMed

    Denk, Tilmann; Neukum, Gerhard; Roatsch, Thomas; Porco, Carolyn C; Burns, Joseph A; Galuba, Götz G; Schmedemann, Nico; Helfenstein, Paul; Thomas, Peter C; Wagner, Roland J; West, Robert A

    2010-01-22

    Since 2004, Saturn's moon Iapetus has been observed repeatedly with the Imaging Science Subsystem of the Cassini spacecraft. The images show numerous impact craters down to the resolution limit of approximately 10 meters per pixel. Small, bright craters within the dark hemisphere indicate a dark blanket thickness on the order of meters or less. Dark, equator-facing and bright, poleward-facing crater walls suggest temperature-driven water-ice sublimation as the process responsible for local albedo patterns. Imaging data also reveal a global color dichotomy, wherein both dark and bright materials on the leading side have a substantially redder color than the respective trailing-side materials. This global pattern indicates an exogenic origin for the redder leading-side parts and suggests that the global color dichotomy initiated the thermal formation of the global albedo dichotomy.

  6. Evaluation of several non-reflecting computational boundary conditions for duct acoustics

    NASA Technical Reports Server (NTRS)

    Watson, Willie R.; Zorumski, William E.; Hodge, Steve L.

    1994-01-01

    Several non-reflecting computational boundary conditions that meet certain criteria and have potential applications to duct acoustics are evaluated for their effectiveness. The same interior solution scheme, grid, and order of approximation are used to evaluate each condition. Sparse matrix solution techniques are applied to solve the matrix equation resulting from the discretization. Modal series solutions for the sound attenuation in an infinite duct are used to evaluate the accuracy of each non-reflecting boundary conditions. The evaluations are performed for sound propagation in a softwall duct, for several sources, sound frequencies, and duct lengths. It is shown that a recently developed nonlocal boundary condition leads to sound attenuation predictions considerably more accurate for short ducts. This leads to a substantial reduction in the number of grid points when compared to other non-reflecting conditions.

  7. Prediction and control of slender-wing rock

    NASA Technical Reports Server (NTRS)

    Kandil, Osama A.; Salman, Ahmed A.

    1992-01-01

    The unsteady Euler equations and the Euler equations of rigid-body dynamics, both written in the moving frame of reference, are sequentially solved to simulate the limit-cycle rock motion of slender delta wings. The governing equations of the fluid flow and the dynamics of the present multidisciplinary problem are solved using an implicit, approximately-factored, central-difference-like, finite-volume scheme and a four-stage Runge-Kutta scheme, respectively. For the control of wing-rock motion, leading-edge flaps are forced to oscillate anti-symmetrically at prescribed frequency and amplitude, which are tuned in order to suppress the rock motion. Since the computational grid deforms due to the leading-edge flaps motion, the grid is dynamically deformed using the Navier-displacement equations. Computational applications cover locally-conical and three-dimensional solutions for the wing-rock simulation and its control.

  8. An approximation technique for predicting the transient response of a second order nonlinear equation

    NASA Technical Reports Server (NTRS)

    Laurenson, R. M.; Baumgarten, J. R.

    1975-01-01

    An approximation technique has been developed for determining the transient response of a nonlinear dynamic system. The nonlinearities in the system which has been considered appear in the system's dissipation function. This function was expressed as a second order polynomial in the system's velocity. The developed approximation is an extension of the classic Kryloff-Bogoliuboff technique. Two examples of the developed approximation are presented for comparative purposes with other approximation methods.

  9. A spectral hybridizable discontinuous Galerkin method for elastic-acoustic wave propagation

    NASA Astrophysics Data System (ADS)

    Terrana, S.; Vilotte, J. P.; Guillot, L.

    2018-04-01

    We introduce a time-domain, high-order in space, hybridizable discontinuous Galerkin (DG) spectral element method (HDG-SEM) for wave equations in coupled elastic-acoustic media. The method is based on a first-order hyperbolic velocity-strain formulation of the wave equations written in conservative form. This method follows the HDG approach by introducing a hybrid unknown, which is the approximation of the velocity on the elements boundaries, as the only globally (i.e. interelement) coupled degrees of freedom. In this paper, we first present a hybridized formulation of the exact Riemann solver at the element boundaries, taking into account elastic-elastic, acoustic-acoustic and elastic-acoustic interfaces. We then use this Riemann solver to derive an explicit construction of the HDG stabilization function τ for all the above-mentioned interfaces. We thus obtain an HDG scheme for coupled elastic-acoustic problems. This scheme is then discretized in space on quadrangular/hexahedral meshes using arbitrary high-order polynomial basis for both volumetric and hybrid fields, using an approach similar to the spectral element methods. This leads to a semi-discrete system of algebraic differential equations (ADEs), which thanks to the structure of the global conservativity condition can be reformulated easily as a classical system of first-order ordinary differential equations in time, allowing the use of classical explicit or implicit time integration schemes. When an explicit time scheme is used, the HDG method can be seen as a reformulation of a DG with upwind fluxes. The introduction of the velocity hybrid unknown leads to relatively simple computations at the element boundaries which, in turn, makes the HDG approach competitive with the DG-upwind methods. Extensive numerical results are provided to illustrate and assess the accuracy and convergence properties of this HDG-SEM. The approximate velocity is shown to converge with the optimal order of k + 1 in the L2-norm, when element polynomials of order k are used, and to exhibit the classical spectral convergence of SEM. Additional inexpensive local post-processing in both the elastic and the acoustic case allow to achieve higher convergence orders. The HDG scheme provides a natural framework for coupling classical, continuous Galerkin SEM with HDG-SEM in the same simulation, and it is shown numerically in this paper. As such, the proposed HDG-SEM can combine the efficiency of the continuous SEM with the flexibility of the HDG approaches. Finally, more complex numerical results, inspired from real geophysical applications, are presented to illustrate the capabilities of the method for wave propagation in heterogeneous elastic-acoustic media with complex geometries.

  10. Screening of charged impurities as a possible mechanism for conductance change in graphene gas sensing

    NASA Astrophysics Data System (ADS)

    Liang, Sang-Zi; Chen, Gugang; Harutyunyan, Avetik R.; Sofo, Jorge O.

    2014-09-01

    In carbon nanotube and graphene gas sensing, the measured conductance change after the sensor is exposed to target molecules has been traditionally attributed to carrier density change due to charge transfer between the sample and the adsorbed molecule. However, this explanation has many problems when it is applied to graphene: The increased amount of Coulomb impurities should lead to decrease in carrier mobility which was not observed in many experiments, carrier density is controlled by the gate voltage in the experimental setup, and there are inconsistencies in the energetics of the charge transfer. In this paper we explore an alternative mechanism. Charged functional groups and dipolar molecules on the surface of graphene may counteract the effect of charged impurities on the substrate. Because scattering of electrons with these charged impurities has been shown to be the limiting factor in graphene conductivity, this leads to significant changes in the transport behavior. A model for the conductivity is established using the random phase approximation dielectric function of graphene and the first-order Born approximation for scattering. The model predicts optimal magnitudes for the charge and dipole moment which maximally screen a given charged impurity. The dipole screening is shown to be generally weaker than the charge screening although the former becomes more effective with higher gate voltage away from the charge neutrality point. The model also predicts that with increasing amount of adsorbates, the charge impurities eventually become saturated and additional adsorption always lead to decreasing conductivity.

  11. Analytical Debye-Huckel model for electrostatic potentials around dissolved DNA.

    PubMed Central

    Wagner, K; Keyes, E; Kephart, T W; Edwards, G

    1997-01-01

    We present an analytical, Green-function-based model for the electric potential of DNA in solution, treating the surrounding solvent with the Debye-Huckel approximation. The partial charge of each atom is accounted for by modeling DNA as linear distributions of atoms on concentric cylindrical surfaces. The condensed ions of the solvent are treated with the Debye-Huckel approximation. The resultant leading term of the potential is that of a continuous shielded line charge, and the higher order terms account for the helical structure. Within several angstroms of the surface there is sufficient information in the electric potential to distinguish features and symmetries of DNA. Plots of the potential and equipotential surfaces, dominated by the phosphate charges, reflect the structural differences between the A, B, and Z conformations and, to a smaller extent, the difference between base sequences. As the distances from the helices increase, the magnitudes of the potentials decrease. However, the bases and sugars account for a larger fraction of the double helix potential with increasing distance. We have found that when the solvent is treated with the Debye-Huckel approximation, the potential decays more rapidly in every direction from the surface than it did in the concentric dielectric cylinder approximation. Images FIGURE 1 FIGURE 2 FIGURE 3 FIGURE 4 FIGURE 5 FIGURE 7 PMID:9199767

  12. A separate phase drag model and a surrogate approximation for simulation of the steam assisted gravity drainage (SAGD) process

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Padrino-Inciarte, Juan Carlos; Ma, Xia; VanderHeyden, W. Brian

    General ensemble phase averaged equations for multiphase flows have been specialized for the simulation of the steam assisted gravity drainage (SAGD) process. In the average momentum equation, fluid-solid and fluid-fluid viscous interactions are represented by separate force terms. This equation has a form similar to that of Darcy’s law for multiphase flow but augmented by the fluid-fluid viscous forces. Models for these fluid-fluid interactions are suggested and implemented into the numerical code CartaBlanca. Numerical results indicate that the model captures the main features of the multiphase flow in the SAGD process, but the detailed features, such as plumes are missed.more » We find that viscous coupling among the fluid phases is important. Advection time scales for the different fluids differ by several orders of magnitude because of vast viscosity differences. Numerically resolving all of these time scales is time consuming. To address this problem, we introduce a steam surrogate approximation to increase the steam advection time scale, while keeping the mass and energy fluxes well approximated. This approximation leads to about a 40-fold speed-up in execution speed of the numerical calculations at the cost of a few percent error in the relevant quantities.« less

  13. A separate phase drag model and a surrogate approximation for simulation of the steam assisted gravity drainage (SAGD) process

    DOE PAGES

    Padrino-Inciarte, Juan Carlos; Ma, Xia; VanderHeyden, W. Brian; ...

    2016-01-01

    General ensemble phase averaged equations for multiphase flows have been specialized for the simulation of the steam assisted gravity drainage (SAGD) process. In the average momentum equation, fluid-solid and fluid-fluid viscous interactions are represented by separate force terms. This equation has a form similar to that of Darcy’s law for multiphase flow but augmented by the fluid-fluid viscous forces. Models for these fluid-fluid interactions are suggested and implemented into the numerical code CartaBlanca. Numerical results indicate that the model captures the main features of the multiphase flow in the SAGD process, but the detailed features, such as plumes are missed.more » We find that viscous coupling among the fluid phases is important. Advection time scales for the different fluids differ by several orders of magnitude because of vast viscosity differences. Numerically resolving all of these time scales is time consuming. To address this problem, we introduce a steam surrogate approximation to increase the steam advection time scale, while keeping the mass and energy fluxes well approximated. This approximation leads to about a 40-fold speed-up in execution speed of the numerical calculations at the cost of a few percent error in the relevant quantities.« less

  14. ``Glue" approximation for the pairing interaction in the Hubbard model with next nearest neighbor hopping

    NASA Astrophysics Data System (ADS)

    Khatami, Ehsan; Macridin, Alexandru; Jarrell, Mark

    2008-03-01

    Recently, several authors have employed the ``glue" approximation for the Cuprates in which the full pairing vertex is approximated by the spin susceptibility. We study this approximation using Quantum Monte Carlo Dynamical Cluster Approximation methods on a 2D Hubbard model. By considering a reasonable finite value for the next nearest neighbor hopping, we find that this ``glue" approximation, in the current form, does not capture the correct pairing symmetry. Here, d-wave is not the leading pairing symmetry while it is the dominant symmetry using the ``exact" QMC results. We argue that the sensitivity of this approximation to the band structure changes leads to this inconsistency and that this form of interaction may not be the appropriate description of the pairing mechanism in Cuprates. We suggest improvements to this approximation which help to capture the the essential features of the QMC data.

  15. Coalescence of two spinning black holes: An effective one-body approach

    NASA Astrophysics Data System (ADS)

    Damour, Thibault

    2001-12-01

    We generalize to the case of spinning black holes a recently introduced ``effective one-body'' approach to the general relativistic dynamics of binary systems. We show how to approximately map the conservative part of the third post-Newtonian (3PN) dynamics of two spinning black holes of masses m1, m2 and spins S1, S2 onto the dynamics of a non-spinning particle of mass μ≡m1m2/(m1+m2) in a certain effective metric geffμν(xλM,ν,a) which can be viewed either as a spin deformation [with the deformation parameter a≡Seff/M] of the recently constructed 3PN effective metric geffμν(xλM,ν), or as a ν deformation [with the comparable-mass deformation parameter ν≡m1m2/(m1+m2)2] of a Kerr metric of mass M≡m1+m2 and (effective) spin Seff≡[1+3m2/(4m1)]S1+[1+3m1/(4m2)]S2. The combination of the effective one-body approach, and of a Padé definition of the crucial effective radial functions, is shown to define a dynamics with much improved post-Newtonian convergence properties, even for black hole separations of the order of 6 GM/c2. The complete (conservative) phase-space evolution equations of binary spinning black hole systems are written down and their exact and approximate first integrals are discussed. This leads to the approximate existence of a two-parameter family of ``spherical orbits'' (with constant radius), and of a corresponding one-parameter family of ``last stable spherical orbits'' (LSSO). These orbits are of special interest for forthcoming LIGO-VIRGO-GEO gravitational wave observations. The binding energy and total angular momentum of LSSO's are studied in some detail. It is argued that for most (but not all) of the parameter space of two spinning holes the approximate (leading-order) effective one-body approach introduced here gives a reliable analytical tool for describing the dynamics of the last orbits before coalescence. This tool predicts, in a quantitative way, how certain spin orientations increase the binding energy of the LSSO. This leads to a detection bias, in LIGO-VIRGO-GEO observations, favoring spinning black hole systems, and makes it urgent to complete the conservative effective one-body dynamics given here by adding (resummed) radiation reaction effects, and by constructing gravitational waveform templates that include spin effects. Finally, our approach predicts that the spin of the final hole formed by the coalescence of two arbitrarily spinning holes never approaches extremality.

  16. Communication: Non-Hadwiger terms in morphological thermodynamics of fluids

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Hansen-Goos, Hendrik, E-mail: hendrik.hansen-goos@uni-tuebingen.de

    We demonstrate that the Hadwiger form of the free energy of a fluid in contact with a wall is insufficient to describe the low-density behavior of a hard-sphere fluid. This implies that morphological thermodynamics of the hard-sphere fluid is an approximate theory if only four geometric measures are included. In order to quantify deviations from the Hadwiger form we extend standard fundamental measure theory of the bulk fluid by introducing additional scaled-particle variables which allow for the description of non-Hadwiger coefficients. The theory is in excellent agreement with recent computer simulations. The fact that the leading non-Hadwiger coefficient is onemore » order of magnitude smaller than the smallest Hadwiger coefficient lends confidence to the numerous results that have been previously obtained within standard morphological thermodynamics.« less

  17. Interface magnetism and electronic structure: ZnO(0001)/Co3O4 (111)

    NASA Astrophysics Data System (ADS)

    Kupchak, I. M.; Serpak, N. F.; Shkrebtii, A.; Hayn, R.

    2018-03-01

    We have studied the structural, electronic, and magnetic properties of spinel Co3O4 (111) surfaces and their interfaces with ZnO(0001) using density functional theory within the generalized gradient approximation with the on-site Coulomb repulsion term. Two possible forms of spinel surface, containing Co2 + or Co3 + ions and terminated with either cobalt or oxygen ions, were considered, as well as their interface with zinc oxide. Our calculations demonstrate that Co3 + ions attain nonzero magnetic moments at the surface and interface, in contrast to the bulk, where they are not magnetic, leading to the ferromagnetic ordering. Since heavily Co doped ZnO samples can contain a Co3O4 secondary phase, such magnetic ordering at the interface might explain the origin of the magnetism in such diluted magnetic semiconductors.

  18. DFTB3: Extension of the self-consistent-charge density-functional tight-binding method (SCC-DFTB).

    PubMed

    Gaus, Michael; Cui, Qiang; Elstner, Marcus

    2012-04-10

    The self-consistent-charge density-functional tight-binding method (SCC-DFTB) is an approximate quantum chemical method derived from density functional theory (DFT) based on a second-order expansion of the DFT total energy around a reference density. In the present study we combine earlier extensions and improve them consistently with, first, an improved Coulomb interaction between atomic partial charges, and second, the complete third-order expansion of the DFT total energy. These modifications lead us to the next generation of the DFTB methodology called DFTB3, which substantially improves the description of charged systems containing elements C, H, N, O, and P, especially regarding hydrogen binding energies and proton affinities. As a result, DFTB3 is particularly applicable to biomolecular systems. Remaining challenges and possible solutions are also briefly discussed.

  19. On mixed derivatives type high dimensional multi-term fractional partial differential equations approximate solutions

    NASA Astrophysics Data System (ADS)

    Talib, Imran; Belgacem, Fethi Bin Muhammad; Asif, Naseer Ahmad; Khalil, Hammad

    2017-01-01

    In this research article, we derive and analyze an efficient spectral method based on the operational matrices of three dimensional orthogonal Jacobi polynomials to solve numerically the mixed partial derivatives type multi-terms high dimensions generalized class of fractional order partial differential equations. We transform the considered fractional order problem to an easily solvable algebraic equations with the aid of the operational matrices. Being easily solvable, the associated algebraic system leads to finding the solution of the problem. Some test problems are considered to confirm the accuracy and validity of the proposed numerical method. The convergence of the method is ensured by comparing our Matlab software simulations based obtained results with the exact solutions in the literature, yielding negligible errors. Moreover, comparative results discussed in the literature are extended and improved in this study.

  20. Numerical simulation of turbulence and terahertz magnetosonic waves generation in collisionless plasmas

    NASA Astrophysics Data System (ADS)

    Kumar, Narender; Singh, Ram Kishor; Sharma, Swati; Uma, R.; Sharma, R. P.

    2018-01-01

    This paper presents numerical simulations of laser beam (x-mode) coupling with a magnetosonic wave (MSW) in a collisionless plasma. The coupling arises through ponderomotive non-linearity. The pump beam has been perturbed by a periodic perturbation that leads to the nonlinear evolution of the laser beam. It is observed that the frequency spectra of the MSW have peaks at terahertz frequencies. The simulation results show quite complex localized structures that grow with time. The ensemble averaged power spectrum has also been studied which indicates that the spectral index follows an approximate scaling of the order of ˜ k-2.1 at large scales and scaling of the order of ˜ k-3.6 at smaller scales. The results indicate considerable randomness in the spatial structure of the magnetic field profile which gives sufficient indication of turbulence.

  1. Nonlinear evolution of Benjamin-Feir wave group based on third order solution of Benjamin-Bona-Mahony equation

    NASA Astrophysics Data System (ADS)

    Zahnur; Halfiani, Vera; Salmawaty; Tulus; Ramli, Marwan

    2018-01-01

    This study concerns on the evolution of trichromatic wave group. It has been known that the trichromatic wave group undergoes an instability during its propagation, which results wave deformation and amplification on the waves amplitude. The previous results on the KdV wave group showed that the nonlinear effect will deform the wave and lead to large wave whose amplitude is higher than the initial input. In this study we consider the Benjamin-Bona-Mahony equation and the theory of third order side band approximation to investigate the peaking and splitting phenomena of the wave groups which is initially in trichromatic signal. The wave amplitude amplification and the maximum position will be observed through a quantity called Maximal Temporal Amplitude (MTA) which measures the maximum amplitude of the waves over time.

  2. Casimir interaction between spheres in ( D + 1)-dimensional Minkowski spacetime

    NASA Astrophysics Data System (ADS)

    Teo, L. P.

    2014-05-01

    We consider the Casimir interaction between two spheres in ( D + 1)-dimensional Minkowski spacetime due to the vacuum fluctuations of scalar fields. We consider combinations of Dirichlet and Neumann boundary conditions. The TGTG formula of the Casimir interaction energy is derived. The computations of the T matrices of the two spheres are straightforward. To compute the two G matrices, known as translation matrices, which relate the hyper-spherical waves in two spherical coordinate frames differ by a translation, we generalize the operator approach employed in [39]. The result is expressed in terms of an integral over Gegenbauer polynomials. In contrast to the D=3 case, we do not re-express the integral in terms of 3 j-symbols and hyper-spherical waves, which in principle, can be done but does not simplify the formula. Using our expression for the Casimir interaction energy, we derive the large separation and small separation asymptotic expansions of the Casimir interaction energy. In the large separation regime, we find that the Casimir interaction energy is of order L -2 D+3, L -2 D+1 and L -2 D-1 respectively for Dirichlet-Dirichlet, Dirichlet-Neumann and Neumann-Neumann boundary conditions, where L is the center-to-center distance of the two spheres. In the small separation regime, we confirm that the leading term of the Casimir interaction agrees with the proximity force approximation, which is of order , where d is the distance between the two spheres. Another main result of this work is the analytic computations of the next-to-leading order term in the small separation asymptotic expansion. This term is computed using careful order analysis as well as perturbation method. In the case the radius of one of the sphere goes to infinity, we find that the results agree with the one we derive for sphere-plate configuration. When D=3, we also recover previously known results. We find that when D is large, the ratio of the next-to-leading order term to the leading order term is linear in D, indicating a larger correction at higher dimensions. The methodologies employed in this work and the results obtained can be used to study the one-loop effective action of the system of two spherical objects in the universe.

  3. Lead isotope systematics of some Apollo 17 soils and some separated components from 76501

    NASA Technical Reports Server (NTRS)

    Church, S. E.; Tilton, G. R.

    1974-01-01

    Isotopic lead data from bulk samples of Apollo 17 soils were analyzed, and they define a chord in a concordia diagram, showing the presence of a component or components containing excess radiogenic lead with Pb-207/Pb-206 equal to about 1.32. The chord is distinctly different from the cataclysm chord, for which Pb-207/Pb-206 is approximately 1.45. Nitric acid analysis of plagioclase indicates lead ages of around 4.35 AE, in agreement with previous findings. Agglutinates from soil 76501,34 show loss of approximately 15% of lead.

  4. Approach for Input Uncertainty Propagation and Robust Design in CFD Using Sensitivity Derivatives

    NASA Technical Reports Server (NTRS)

    Putko, Michele M.; Taylor, Arthur C., III; Newman, Perry A.; Green, Lawrence L.

    2002-01-01

    An implementation of the approximate statistical moment method for uncertainty propagation and robust optimization for quasi 3-D Euler CFD code is presented. Given uncertainties in statistically independent, random, normally distributed input variables, first- and second-order statistical moment procedures are performed to approximate the uncertainty in the CFD output. Efficient calculation of both first- and second-order sensitivity derivatives is required. In order to assess the validity of the approximations, these moments are compared with statistical moments generated through Monte Carlo simulations. The uncertainties in the CFD input variables are also incorporated into a robust optimization procedure. For this optimization, statistical moments involving first-order sensitivity derivatives appear in the objective function and system constraints. Second-order sensitivity derivatives are used in a gradient-based search to successfully execute a robust optimization. The approximate methods used throughout the analyses are found to be valid when considering robustness about input parameter mean values.

  5. Quantitative kinetic theory of active matter

    NASA Astrophysics Data System (ADS)

    Ihle, Thomas; Chou, Yen-Liang

    2014-03-01

    Models of self-driven agents similar to the Vicsek model [Phys. Rev. Lett. 75 (1995) 1226] are studied by means of kinetic theory. In these models, particles try to align their travel directions with the average direction of their neighbours. At strong alignment a globally ordered state of collective motion forms. An Enskog-like kinetic theory is derived from the exact Chapman-Kolmogorov equation in phase space using Boltzmann's mean-field approximation of molecular chaos. The kinetic equation is solved numerically by a nonlocal Lattice-Boltzmann-like algorithm. Steep soliton-like waves are observed that lead to an abrupt jump of the global order parameter if the noise level is changed. The shape of the wave is shown to follow a novel scaling law and to quantitatively agree within 3 % with agent-based simulations at large particle speeds. This provides a mean-field mechanism to change the second-order character of the flocking transition to first order. Diagrammatic techniques are used to investigate small particle speeds, where the mean-field assumption of Molecular Chaos is invalid and where correlation effects need to be included.

  6. Modeling the global positioning system signal propagation through the ionosphere

    NASA Technical Reports Server (NTRS)

    Bassiri, S.; Hajj, G. A.

    1992-01-01

    Based on realistic modeling of the electron density of the ionosphere and using a dipole moment approximation for the Earth's magnetic field, one is able to estimate the effect of the ionosphere on the Global Positioning System (GPS) signal for a ground user. The lowest order effect, which is on the order of 0.1-100 m of group delay, is subtracted out by forming a linear combination of the dual frequencies of the GPS signal. One is left with second- and third-order effects that are estimated typically to be approximately 0-2 cm and approximately 0-2 mm at zenith, respectively, depending on the geographical location, the time of day, the time of year, the solar cycle, and the relative geometry of the magnetic field and the line of sight. Given the total electron content along a line of sight, the authors derive an approximation to the second-order term which is accurate to approximately 90 percent within the magnetic dipole moment model; this approximation can be used to reduce the second-order term to the millimeter level, thus potentially improving precise positioning in space and on the ground. The induced group delay, or phase advance, due to second- and third-order effects is examined for two ground receivers located at equatorial and mid-latitude regions tracking several GPS satellites.

  7. NLO perturbativity bounds on quartic couplings in renormalizable theories with Φ 4 -like scalar sectors

    DOE PAGES

    Murphy, Christopher W.

    2017-08-17

    The apparent breakdown of unitarity in low order perturbation theory is often is used to place bounds on the parameters of a theory. In this work we give an algorithm for approximately computing the next-to-leading order (NLO) perturbativity bounds on the quartic couplings of a renormalizable theory whose scalar sector is Φ 4 -like. And by this we mean theories where either there are no cubic scalar interactions, or the cubic couplings are related to the quartic couplings through spontaneous symmetry breaking. Furthermore, the quantity that tests where perturbation theory breaks down itself can be written as a perturbative series,more » and having the NLO terms allows one to test how well the series converges. We also present a simple example to illustrate the effect of considering these bounds at different orders in perturbation theory. For example, there is a noticeable difference in the viable parameter when the square of the NLO piece is included versus when it is not.« less

  8. Piezoelectric Field Enhanced Second-Order Nonlinear Optical Susceptibilities in Wurtzite GaN/AlGaN Quantum Wells

    NASA Technical Reports Server (NTRS)

    Liu, Ansheng; Chuang, S.-L.; Ning, C. Z.; Woo, Alex (Technical Monitor)

    1999-01-01

    Second-order nonlinear optical processes including second-harmonic generation, optical rectification, and difference-frequency generation associated with intersubband transitions in wurtzite GaN/AlGaN quantum well (QW) are investigated theoretically. Taking into account the strain-induced piezoelectric (PZ) effects, we solve the electronic structure of the QW from coupled effective-mass Schrodinger equation and Poisson equation including the exchange-correlation effect under the local-density approximation. We show that the large PZ field in the QW breaks the symmetry of the confinement potential profile and leads to large second-order susceptibilities. We also show that the interband optical pump-induced electron-hole plasma results in an enhancement in the maximum value of the nonlinear coefficients and a redshift of the peak position in the nonlinear optical spectrum. By use of the difference-frequency generation, THz radiation can be generated from a GaN/Al(0.75)Ga(0.25)N with a pump laser of 1.55 micron.

  9. Refined boundary conditions on the free surface of an elastic half-space taking into account non-local effects.

    PubMed

    Chebakov, R; Kaplunov, J; Rogerson, G A

    2016-02-01

    The dynamic response of a homogeneous half-space, with a traction-free surface, is considered within the framework of non-local elasticity. The focus is on the dominant effect of the boundary layer on overall behaviour. A typical wavelength is assumed to considerably exceed the associated internal lengthscale. The leading-order long-wave approximation is shown to coincide formally with the 'local' problem for a half-space with a vertical inhomogeneity localized near the surface. Subsequent asymptotic analysis of the inhomogeneity results in an explicit correction to the classical boundary conditions on the surface. The order of the correction is greater than the order of the better-known correction to the governing differential equations. The refined boundary conditions enable us to evaluate the interior solution outside a narrow boundary layer localized near the surface. As an illustration, the effect of non-local elastic phenomena on the Rayleigh wave speed is investigated.

  10. High-Precision Differential Predictions for Top-Quark Pairs at the LHC

    NASA Astrophysics Data System (ADS)

    Czakon, Michal; Heymes, David; Mitov, Alexander

    2016-02-01

    We present the first complete next-to-next-to-leading order (NNLO) QCD predictions for differential distributions in the top-quark pair production process at the LHC. Our results are derived from a fully differential partonic Monte Carlo calculation with stable top quarks which involves no approximations beyond the fixed-order truncation of the perturbation series. The NNLO corrections improve the agreement between existing LHC measurements [V. Khachatryan et al. (CMS Collaboration), Eur. Phys. J. C 75, 542 (2015)] and standard model predictions for the top-quark transverse momentum distribution, thus helping alleviate one long-standing discrepancy. The shape of the top-quark pair invariant mass distribution turns out to be stable with respect to radiative corrections beyond NLO which increases the value of this observable as a place to search for physics beyond the standard model. The results presented here provide essential input for parton distribution function fits, implementation of higher-order effects in Monte Carlo generators, as well as top-quark mass and strong coupling determination.

  11. High-Precision Differential Predictions for Top-Quark Pairs at the LHC.

    PubMed

    Czakon, Michal; Heymes, David; Mitov, Alexander

    2016-02-26

    We present the first complete next-to-next-to-leading order (NNLO) QCD predictions for differential distributions in the top-quark pair production process at the LHC. Our results are derived from a fully differential partonic Monte Carlo calculation with stable top quarks which involves no approximations beyond the fixed-order truncation of the perturbation series. The NNLO corrections improve the agreement between existing LHC measurements [V. Khachatryan et al. (CMS Collaboration), Eur. Phys. J. C 75, 542 (2015)] and standard model predictions for the top-quark transverse momentum distribution, thus helping alleviate one long-standing discrepancy. The shape of the top-quark pair invariant mass distribution turns out to be stable with respect to radiative corrections beyond NLO which increases the value of this observable as a place to search for physics beyond the standard model. The results presented here provide essential input for parton distribution function fits, implementation of higher-order effects in Monte Carlo generators, as well as top-quark mass and strong coupling determination.

  12. Thermal helium clusters at 3.2 Kelvin in classical and semiclassical simulations

    NASA Astrophysics Data System (ADS)

    Schulte, J.

    1993-03-01

    The thermodynamic stability of4He4-13 at 3.2 K is investigated with the classical Monte Carlo method, with the semiclassical path-integral Monte Carlo (PIMC) method, and with the semiclassical all-order many-body method. In the all-order many-body simulation the dipole-dipole approximation including short-range correction is used. The resulting stability plots are discussed and related to recent TOF experiments by Stephens and King. It is found that with classical Monte Carlo of course the characteristics of the measured mass spectrum cannot be resolved. With PIMC, switching on more and more quantum mechanics. by raising the number of virtual time steps results in more structure in the stability plot, but this did not lead to sufficient agreement with the TOF experiment. Only the all-order many-body method resolved the characteristic structures of the measured mass spectrum, including magic numbers. The result shows the influence of quantum statistics and quantum mechanics on the stability of small neutral helium clusters.

  13. Freeze-out conditions in heavy ion collisions from QCD thermodynamics.

    PubMed

    Bazavov, A; Ding, H-T; Hegde, P; Kaczmarek, O; Karsch, F; Laermann, E; Mukherjee, Swagato; Petreczky, P; Schmidt, C; Smith, D; Soeldner, W; Wagner, M

    2012-11-09

    We present a determination of freeze-out conditions in heavy ion collisions based on ratios of cumulants of net electric charge fluctuations. These ratios can reliably be calculated in lattice QCD for a wide range of chemical potential values by using a next-to-leading order Taylor series expansion around the limit of vanishing baryon, electric charge and strangeness chemical potentials. From a computation of up to fourth order cumulants and charge correlations we first determine the strangeness and electric charge chemical potentials that characterize freeze-out conditions in a heavy ion collision and confirm that in the temperature range 150 MeV ≤ T ≤ 170 MeV the hadron resonance gas model provides good approximations for these parameters that agree with QCD calculations on the 5%-15% level. We then show that a comparison of lattice QCD results for ratios of up to third order cumulants of electric charge fluctuations with experimental results allows us to extract the freeze-out baryon chemical potential and the freeze-out temperature.

  14. Deformations of a pre-stretched elastic membrane driven by non-uniform electroosmotic flow

    NASA Astrophysics Data System (ADS)

    Bercovici, Moran; Boyko, Evgeniy; Gat, Amir

    2016-11-01

    We study viscous-elastic dynamics of fluid confined between a rigid plate and a pre-stretched elastic membrane subjected to non-uniform electroosmotic flow, and focus on the case of a finite-size membrane clamped at its boundaries. Considering small deformations of a strongly pre-stretched membrane, and applying the lubrication approximation for the flow, we derive a linearized leading-order non-homogenous 4th order diffusion equation governing the deformation and pressure fields. We derive a time-dependent Green's function for a rectangular domain, and use it to obtain several basic solutions for the cases of constant and time varying electric fields. In addition, defining an asymptotic expansion where the small parameter is the ratio of the induced to prescribed tension, we obtain a set of four one-way coupled equations providing a first order correction for the deformation field. Funded by the European Research Council (ERC) under the Horizon 2020 Research and Innovation Programme, Grant agreement No. 678734 (MetamorphChip).

  15. Generalized soldering of {+-}2 helicity states in D=2+1

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Dalmazi, D.; Mendonca, Elias L.

    2009-07-15

    The direct sum of a couple of Maxwell-Chern-Simons gauge theories of opposite helicities {+-}1 does not lead to a Proca theory in D=2+1, although both theories share the same spectrum. However, it is known that by adding an interference term between both helicities we can join the complementary pieces together and obtain the physically expected result. A generalized soldering procedure can be defined to generate the missing interference term. Here, we show that the same procedure can be applied to join together {+-}2 helicity states in a full off-shell manner. In particular, by using second-order (in derivatives) self-dual models ofmore » helicities {+-}2 (spin-2 analogues of Maxwell-Chern-Simmons models) the Fierz-Pauli theory is obtained after soldering. Remarkably, if we replace the second-order models by third-order self-dual models (linearized topologically massive gravity) of opposite helicities, after soldering, we end up exactly with the new massive gravity theory of Bergshoeff, Hohm, and Townsend in its linearized approximation.« less

  16. Graviton mass or cosmological constant?

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Gabadadze, Gregory; Gruzinov, Andrei

    2005-12-15

    To describe a massive graviton in 4D Minkowski space-time one introduces a quadratic term in the Lagrangian. This term, however, can lead to a readjustment or instability of the background instead of describing a massive graviton on flat space. We show that for all local 4D Lorentz-invariant mass terms Minkowski space is unstable. The instability can develop in a time scale that is many orders of magnitude shorter than the inverse graviton mass. We start with the Pauli-Fierz (PF) term that is the only local mass term with no ghosts in the linearized approximation. We show that nonlinear completions ofmore » the PF Lagrangian give rise to instability of Minkowski space. We continue with the mass terms that are not of a PF type. Although these models are known to have ghosts in the linearized approximations, nonlinear interactions can lead to background change in which the ghosts are eliminated. In the latter case, however, the graviton perturbations on the new background are not massive. We argue that a consistent theory of a massive graviton on flat space can be formulated in theories with extra dimensions. They require an infinite number of fields or nonlocal description from a 4D point of view.« less

  17. Role of facet curvature for accurate vertebral facet load analysis.

    PubMed

    Holzapfel, Gerhard A; Stadler, Michael

    2006-06-01

    The curvature of vertebral facet joints may play an important role in the study of load-bearing characteristics and clinical interventions such as graded facetectomy. In previously-published finite element simulations of this procedure, the curvature was either neglected or approximated with a varying degree of accuracy. Here we study the effect of the curvature in three different load situations by using a numerical model which is able to represent the actual curvature without any loss of accuracy. The results show that previously-used approximations of the curvature lead to good results in the analysis of sagittal moment/rotation. However, for sagittal shear-force/displacement and for the contact stress distribution, previous results deviate significantly from our results. These findings are supported through related convergence studies. Hence we can conclude that in order to obtain reliable results for the analysis of sagittal shear-force/displacement and the contact stress distribution in the facet joint, the curvature must not be neglected. This is of particular importance for the numerical simulation of the spine, which may lead to improved diagnostics, effective surgical planning and intervention. The proposed method may represent a more reliable basis for optimizing the biomedical engineering design for tissue engineering or, for example, for spinal implants.

  18. The Angular Three-Point Correlation Function in the Quasi-linear Regime

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Buchalter, Ari; Kamionkowski, Marc; Jaffe, Andrew H.

    2000-02-10

    We calculate the normalized angular three-point correlation function (3PCF), q, as well as the normalized angular skewness, s{sub 3}, assuming the small-angle approximation, for a biased mass distribution in flat and open cold dark matter (CDM) models with Gaussian initial conditions. The leading-order perturbative results incorporate the explicit dependence on the cosmological parameters, the shape of the CDM transfer function, the linear evolution of the power spectrum, the form of the assumed redshift distribution function, and linear and nonlinear biasing, which may be evolving. Results are presented for different redshift distributions, including that appropriate for the APM Galaxy Survey, asmore » well as for a survey with a mean redshift of z{approx_equal}1 (such as the VLA FIRST Survey). Qualitatively, many of the results found for s{sub 3} and q are similar to those obtained in a related treatment of the spatial skewness and 3PCF, such as a leading-order correction to the standard result for s{sub 3} in the case of nonlinear bias (as defined for unsmoothed density fields), and the sensitivity of the configuration dependence of q to both cosmological and biasing models. We show that since angular correlation functions (CFs) are sensitive to clustering over a range of redshifts, the various evolutionary dependences included in our predictions imply that measurements of q in a deep survey might better discriminate between models with different histories, such as evolving versus nonevolving bias, that can have similar spatial CFs at low redshift. Our calculations employ a derived equation, valid for open, closed, and flat models, to obtain the angular bispectrum from the spatial bispectrum in the small-angle approximation. (c) (c) 2000. The American Astronomical Society.« less

  19. Thomson scattering diagnostics of thermal plasmas: Laser heating of electrons and the existence of local thermodynamic equilibrium.

    PubMed

    Murphy, A B

    2004-01-01

    A number of assessments of electron temperatures in atmospheric-pressure arc plasmas using Thomson scattering of laser light have recently been published. However, in this method, the electron temperature is perturbed due to strong heating of the electrons by the incident laser beam. This heating was taken into account by measuring the electron temperature as a function of the laser pulse energy, and linearly extrapolating the results to zero pulse energy to obtain an unperturbed electron temperature. In the present paper, calculations show that the laser heating process has a highly nonlinear dependence on laser power, and that the usual linear extrapolation leads to an overestimate of the electron temperature, typically by 5000 K. The nonlinearity occurs due to the strong dependence on electron temperature of the absorption of laser energy and of the collisional and radiative cooling of the heated electrons. There are further problems in deriving accurate electron temperatures from laser scattering due to necessary averages that have to be made over the duration of the laser pulse and over the finite volume from which laser light is scattered. These problems are particularly acute in measurements in which the laser beam is defocused in order to minimize laser heating; this can lead to the derivation of electron temperatures that are significantly greater than those existing anywhere in the scattering volume. It was concluded from the earlier Thomson scattering measurements that there were significant deviations from equilibrium between the electron and heavy-particle temperatures at the center of arc plasmas of industrial interest. The present calculations indicate that such deviations are only of the order of 1000 K in 20 000 K, so that the usual approximation that arc plasmas are approximately in local thermodynamic equilibrium still applies.

  20. Measurement of double-differential cross sections for top quark pair production in pp collisions at √{s} = 8 {TeV} and impact on parton distribution functions

    NASA Astrophysics Data System (ADS)

    Sirunyan, A. M.; Tumasyan, A.; Adam, W.; Asilar, E.; Bergauer, T.; Brandstetter, J.; Brondolin, E.; Dragicevic, M.; Erö, J.; Flechl, M.; Friedl, M.; Frühwirth, R.; Ghete, V. M.; Hartl, C.; Hörmann, N.; Hrubec, J.; Jeitler, M.; König, A.; Krätschmer, I.; Liko, D.; Matsushita, T.; Mikulec, I.; Rabady, D.; Rad, N.; Rahbaran, B.; Rohringer, H.; Schieck, J.; Strauss, J.; Waltenberger, W.; Wulz, C.-E.; Dvornikov, O.; Makarenko, V.; Mossolov, V.; Suarez Gonzalez, J.; Zykunov, V.; Shumeiko, N.; Alderweireldt, S.; De Wolf, E. A.; Janssen, X.; Lauwers, J.; Van De Klundert, M.; Van Haevermaet, H.; Van Mechelen, P.; Van Remortel, N.; Van Spilbeeck, A.; Abu Zeid, S.; Blekman, F.; D'Hondt, J.; Daci, N.; De Bruyn, I.; Deroover, K.; Lowette, S.; Moortgat, S.; Moreels, L.; Olbrechts, A.; Python, Q.; Skovpen, K.; Tavernier, S.; Van Doninck, W.; Van Mulders, P.; Van Parijs, I.; Brun, H.; Clerbaux, B.; De Lentdecker, G.; Delannoy, H.; Fasanella, G.; Favart, L.; Goldouzian, R.; Grebenyuk, A.; Karapostoli, G.; Lenzi, T.; Léonard, A.; Luetic, J.; Maerschalk, T.; Marinov, A.; Randle-conde, A.; Seva, T.; Vander Velde, C.; Vanlaer, P.; Vannerom, D.; Yonamine, R.; Zenoni, F.; Zhang, F.; Cornelis, T.; Dobur, D.; Fagot, A.; Gul, M.; Khvastunov, I.; Poyraz, D.; Salva, S.; Schöfbeck, R.; Tytgat, M.; Van Driessche, W.; Yazgan, E.; Zaganidis, N.; Bakhshiansohi, H.; Bondu, O.; Brochet, S.; Bruno, G.; Caudron, A.; De Visscher, S.; Delaere, C.; Delcourt, M.; Francois, B.; Giammanco, A.; Jafari, A.; Komm, M.; Krintiras, G.; Lemaitre, V.; Magitteri, A.; Mertens, A.; Musich, M.; Piotrzkowski, K.; Quertenmont, L.; Selvaggi, M.; Vidal Marono, M.; Wertz, S.; Beliy, N.; Aldá Júnior, W. L.; Alves, F. L.; Alves, G. A.; Brito, L.; Hensel, C.; Moraes, A.; Pol, M. E.; Rebello Teles, P.; Chagas, E. Belchior Batista Das; Carvalho, W.; Chinellato, J.; Custódio, A.; Da Costa, E. M.; Da Silveira, G. G.; De Jesus Damiao, D.; De Oliveira Martins, C.; De Souza, S. Fonseca; Guativa, L. M. Huertas; Malbouisson, H.; Matos Figueiredo, D.; Mora Herrera, C.; Mundim, L.; Nogima, H.; Prado Da Silva, W. L.; Santoro, A.; Sznajder, A.; Tonelli Manganote, E. J.; Torres Da Silva De Araujo, F.; Vilela Pereira, A.; Ahuja, S.; Bernardes, C. A.; Dogra, S.; Fernandez Perez Tomei, T. R.; Gregores, E. M.; Mercadante, P. G.; Moon, C. S.; Novaes, S. F.; Padula, Sandra S.; Romero Abad, D.; Ruiz Vargas, J. C.; Aleksandrov, A.; Hadjiiska, R.; Iaydjiev, P.; Rodozov, M.; Stoykova, S.; Sultanov, G.; Vutova, M.; Dimitrov, A.; Glushkov, I.; Litov, L.; Pavlov, B.; Petkov, P.; Fang, W.; Ahmad, M.; Bian, J. G.; Chen, G. M.; Chen, H. S.; Chen, M.; Chen, Y.; Cheng, T.; Jiang, C. H.; Leggat, D.; Liu, Z.; Romeo, F.; Ruan, M.; Shaheen, S. M.; Spiezia, A.; Tao, J.; Wang, C.; Wang, Z.; Zhang, H.; Zhao, J.; Ban, Y.; Chen, G.; Li, Q.; Liu, S.; Mao, Y.; Qian, S. J.; Wang, D.; Xu, Z.; Avila, C.; Cabrera, A.; Chaparro Sierra, L. F.; Florez, C.; Gomez, J. P.; González Hernández, C. F.; Ruiz Alvarez, J. D.; Sanabria, J. C.; Godinovic, N.; Lelas, D.; Puljak, I.; Ribeiro Cipriano, P. M.; Sculac, T.; Antunovic, Z.; Kovac, M.; Brigljevic, V.; Ferencek, D.; Kadija, K.; Mesic, B.; Susa, T.; Ather, M. W.; Attikis, A.; Mavromanolakis, G.; Mousa, J.; Nicolaou, C.; Ptochos, F.; Razis, P. A.; Rykaczewski, H.; Finger, M.; Finger, M.; Carrera Jarrin, E.; Ellithi Kamel, A.; Mahmoud, M. A.; Radi, A.; Kadastik, M.; Perrini, L.; Raidal, M.; Tiko, A.; Veelken, C.; Eerola, P.; Pekkanen, J.; Voutilainen, M.; Härkönen, J.; Järvinen, T.; Karimäki, V.; Kinnunen, R.; Lampén, T.; Lassila-Perini, K.; Lehti, S.; Lindén, T.; Luukka, P.; Tuominiemi, J.; Tuovinen, E.; Wendland, L.; Talvitie, J.; Tuuva, T.; Besancon, M.; Couderc, F.; Dejardin, M.; Denegri, D.; Fabbro, B.; Faure, J. L.; Favaro, C.; Ferri, F.; Ganjour, S.; Ghosh, S.; Givernaud, A.; Gras, P.; Hamel de Monchenault, G.; Jarry, P.; Kucher, I.; Locci, E.; Machet, M.; Malcles, J.; Rander, J.; Rosowsky, A.; Titov, M.; Abdulsalam, A.; Antropov, I.; Baffioni, S.; Beaudette, F.; Busson, P.; Cadamuro, L.; Chapon, E.; Charlot, C.; Davignon, O.; Granier de Cassagnac, R.; Jo, M.; Lisniak, S.; Miné, P.; Nguyen, M.; Ochando, C.; Ortona, G.; Paganini, P.; Pigard, P.; Regnard, S.; Salerno, R.; Sirois, Y.; Stahl Leiton, A. G.; Strebler, T.; Yilmaz, Y.; Zabi, A.; Zghiche, A.; Agram, J.-L.; Andrea, J.; Bloch, D.; Brom, J.-M.; Buttignol, M.; Chabert, E. C.; Chanon, N.; Collard, C.; Conte, E.; Coubez, X.; Fontaine, J.-C.; Gelé, D.; Goerlach, U.; Bihan, A.-C. Le; Van Hove, P.; Gadrat, S.; Beauceron, S.; Bernet, C.; Boudoul, G.; Carrillo Montoya, C. A.; Chierici, R.; Contardo, D.; Courbon, B.; Depasse, P.; El Mamouni, H.; Fay, J.; Finco, L.; Gascon, S.; Gouzevitch, M.; Grenier, G.; Ille, B.; Lagarde, F.; Laktineh, I. B.; Lethuillier, M.; Mirabito, L.; Pequegnot, A. L.; Perries, S.; Popov, A.; Sordini, V.; Vander Donckt, M.; Verdier, P.; Viret, S.; Khvedelidze, A.; Lomidze, D.; Autermann, C.; Beranek, S.; Feld, L.; Kiesel, M. K.; Klein, K.; Lipinski, M.; Preuten, M.; Schomakers, C.; Schulz, J.; Verlage, T.; Albert, A.; Brodski, M.; Dietz-Laursonn, E.; Duchardt, D.; Endres, M.; Erdmann, M.; Erdweg, S.; Esch, T.; Fischer, R.; Güth, A.; Hamer, M.; Hebbeker, T.; Heidemann, C.; Hoepfner, K.; Knutzen, S.; Merschmeyer, M.; Meyer, A.; Millet, P.; Mukherjee, S.; Olschewski, M.; Padeken, K.; Pook, T.; Radziej, M.; Reithler, H.; Rieger, M.; Scheuch, F.; Sonnenschein, L.; Teyssier, D.; Thüer, S.; Cherepanov, V.; Flügge, G.; Kargoll, B.; Kress, T.; Künsken, A.; Lingemann, J.; Müller, T.; Nehrkorn, A.; Nowack, A.; Pistone, C.; Pooth, O.; Stahl, A.; Aldaya Martin, M.; Arndt, T.; Asawatangtrakuldee, C.; Beernaert, K.; Behnke, O.; Behrens, U.; Bin Anuar, A. A.; Borras, K.; Campbell, A.; Connor, P.; Contreras-Campana, C.; Costanza, F.; Diez Pardos, C.; Dolinska, G.; Eckerlin, G.; Eckstein, D.; Eichhorn, T.; Eren, E.; Gallo, E.; Garay Garcia, J.; Geiser, A.; Gizhko, A.; Grados Luyando, J. M.; Grohsjean, A.; Gunnellini, P.; Harb, A.; Hauk, J.; Hempel, M.; Jung, H.; Kalogeropoulos, A.; Karacheban, O.; Kasemann, M.; Keaveney, J.; Kleinwort, C.; Korol, I.; Krücker, D.; Lange, W.; Lelek, A.; Lenz, T.; Leonard, J.; Lipka, K.; Lobanov, A.; Lohmann, W.; Mankel, R.; Melzer-Pellmann, I.-A.; Meyer, A. B.; Mittag, G.; Mnich, J.; Mussgiller, A.; Pitzl, D.; Placakyte, R.; Raspereza, A.; Roland, B.; Sahin, M. Ö.; Saxena, P.; Schoerner-Sadenius, T.; Spannagel, S.; Stefaniuk, N.; Van Onsem, G. P.; Walsh, R.; Wissing, C.; Zenaiev, O.; Blobel, V.; Centis Vignali, M.; Draeger, A. R.; Dreyer, T.; Garutti, E.; Gonzalez, D.; Haller, J.; Hoffmann, M.; Junkes, A.; Klanner, R.; Kogler, R.; Kovalchuk, N.; Kurz, S.; Lapsien, T.; Marchesini, I.; Marconi, D.; Meyer, M.; Niedziela, M.; Nowatschin, D.; Pantaleo, F.; Peiffer, T.; Perieanu, A.; Scharf, C.; Schleper, P.; Schmidt, A.; Schumann, S.; Schwandt, J.; Sonneveld, J.; Stadie, H.; Steinbrück, G.; Stober, F. M.; Stöver, M.; Tholen, H.; Troendle, D.; Usai, E.; Vanelderen, L.; Vanhoefer, A.; Vormwald, B.; Akbiyik, M.; Barth, C.; Baur, S.; Baus, C.; Berger, J.; Butz, E.; Caspart, R.; Chwalek, T.; Colombo, F.; De Boer, W.; Dierlamm, A.; Fink, S.; Freund, B.; Friese, R.; Giffels, M.; Gilbert, A.; Goldenzweig, P.; Haitz, D.; Hartmann, F.; Heindl, S. M.; Husemann, U.; Kassel, F.; Katkov, I.; Kudella, S.; Mildner, H.; Mozer, M. U.; Müller, Th.; Plagge, M.; Quast, G.; Rabbertz, K.; Röcker, S.; Roscher, F.; Schröder, M.; Shvetsov, I.; Sieber, G.; Simonis, H. J.; Ulrich, R.; Wayand, S.; Weber, M.; Weiler, T.; Williamson, S.; Wöhrmann, C.; Wolf, R.; Anagnostou, G.; Daskalakis, G.; Geralis, T.; Giakoumopoulou, V. A.; Kyriakis, A.; Loukas, D.; Topsis-Giotis, I.; Kesisoglou, S.; Panagiotou, A.; Saoulidou, N.; Tziaferi, E.; Kousouris, K.; Evangelou, I.; Flouris, G.; Foudas, C.; Kokkas, P.; Loukas, N.; Manthos, N.; Papadopoulos, I.; Paradas, E.; Filipovic, N.; Pasztor, G.; Bencze, G.; Hajdu, C.; Horvath, D.; Sikler, F.; Veszpremi, V.; Vesztergombi, G.; Zsigmond, A. J.; Beni, N.; Czellar, S.; Karancsi, J.; Makovec, A.; Molnar, J.; Szillasi, Z.; Bartók, M.; Raics, P.; Trocsanyi, Z. L.; Ujvari, B.; Komaragiri, J. R.; Bahinipati, S.; Bhowmik, S.; Choudhury, S.; Mal, P.; Mandal, K.; Nayak, A.; Sahoo, D. K.; Sahoo, N.; Swain, S. K.; Bansal, S.; Beri, S. B.; Bhatnagar, V.; Chawla, R.; Bhawandeep, U.; Kalsi, A. K.; Kaur, A.; Kaur, M.; Kumar, R.; Kumari, P.; Mehta, A.; Mittal, M.; Singh, J. B.; Walia, G.; Kumar, Ashok; Bhardwaj, A.; Choudhary, B. C.; Garg, R. B.; Keshri, S.; Kumar, A.; Malhotra, S.; Naimuddin, M.; Ranjan, K.; Sharma, R.; Sharma, V.; Bhattacharya, R.; Bhattacharya, S.; Chatterjee, K.; Dey, S.; Dutt, S.; Dutta, S.; Ghosh, S.; Majumdar, N.; Modak, A.; Mondal, K.; Mukhopadhyay, S.; Nandan, S.; Purohit, A.; Roy, A.; Roy, D.; Roy Chowdhury, S.; Sarkar, S.; Sharan, M.; Thakur, S.; Behera, P. K.; Chudasama, R.; Dutta, D.; Jha, V.; Kumar, V.; Mohanty, A. K.; Netrakanti, P. K.; Pant, L. M.; Shukla, P.; Topkar, A.; Aziz, T.; Dugad, S.; Kole, G.; Mahakud, B.; Mitra, S.; Mohanty, G. B.; Parida, B.; Sur, N.; Sutar, B.; Banerjee, S.; Dewanjee, R. K.; Ganguly, S.; Guchait, M.; Jain, Sa.; Kumar, S.; Maity, M.; Majumder, G.; Mazumdar, K.; Sarkar, T.; Wickramage, N.; Chauhan, S.; Dube, S.; Hegde, V.; Kapoor, A.; Kothekar, K.; Pandey, S.; Rane, A.; Sharma, S.; Chenarani, S.; Eskandari Tadavani, E.; Etesami, S. M.; Khakzad, M.; Mohammadi Najafabadi, M.; Naseri, M.; Paktinat Mehdiabadi, S.; Rezaei Hosseinabadi, F.; Safarzadeh, B.; Zeinali, M.; Felcini, M.; Grunewald, M.; Abbrescia, M.; Calabria, C.; Caputo, C.; Colaleo, A.; Creanza, D.; Cristella, L.; De Filippis, N.; De Palma, M.; Fiore, L.; Iaselli, G.; Maggi, G.; Maggi, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Pugliese, G.; Radogna, R.; Ranieri, A.; Selvaggi, G.; Sharma, A.; Silvestris, L.; Venditti, R.; Verwilligen, P.; Abbiendi, G.; Battilana, C.; Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Cavallo, F. R.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Dallavalle, G. M.; Fabbri, F.; Fanfani, A.; Fasanella, D.; Giacomelli, P.; Grandi, C.; Guiducci, L.; Marcellini, S.; Masetti, G.; Montanari, A.; Navarria, F. L.; Perrotta, A.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.; Albergo, S.; Costa, S.; Di Mattia, A.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.; Barbagli, G.; Ciulli, V.; Civinini, C.; D'Alessandro, R.; Focardi, E.; Lenzi, P.; Meschini, M.; Paoletti, S.; Russo, L.; Sguazzoni, G.; Strom, D.; Viliani, L.; Benussi, L.; Bianco, S.; Fabbri, F.; Piccolo, D.; Primavera, F.; Calvelli, V.; Ferro, F.; Monge, M. R.; Robutti, E.; Tosi, S.; Brianza, L.; Brivio, F.; Ciriolo, V.; Dinardo, M. E.; Fiorendi, S.; Gennai, S.; Ghezzi, A.; Govoni, P.; Malberti, M.; Malvezzi, S.; Manzoni, R. A.; Menasce, D.; Moroni, L.; Paganoni, M.; Pedrini, D.; Pigazzini, S.; Ragazzi, S.; Tabarelli de Fatis, T.; Buontempo, S.; Cavallo, N.; De Nardo, G.; Di Guida, S.; Esposito, M.; Fabozzi, F.; Fienga, F.; Iorio, A. O. M.; Lanza, G.; Lista, L.; Meola, S.; Paolucci, P.; Sciacca, C.; Thyssen, F.; Azzi, P.; Bacchetta, N.; Benato, L.; Bisello, D.; Boletti, A.; Carlin, R.; Antunes De Oliveira, A. Carvalho; Checchia, P.; Dall'Osso, M.; De Castro Manzano, P.; Dorigo, T.; Dosselli, U.; Gasparini, U.; Gonella, F.; Lacaprara, S.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Rossin, R.; Simonetto, F.; Torassa, E.; Ventura, S.; Zanetti, M.; Zotto, P.; Braghieri, A.; Fallavollita, F.; Magnani, A.; Montagna, P.; Ratti, S. P.; Re, V.; Ressegotti, M.; Riccardi, C.; Salvini, P.; Vai, I.; Vitulo, P.; Alunni Solestizi, L.; Bilei, G. M.; Ciangottini, D.; Fanò, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Mariani, V.; Menichelli, M.; Saha, A.; Santocchia, A.; Androsov, K.; Azzurri, P.; Bagliesi, G.; Bernardini, J.; Boccali, T.; Castaldi, R.; Ciocci, M. A.; Dell'Orso, R.; Fedi, G.; Giassi, A.; Grippo, M. T.; Ligabue, F.; Lomtadze, T.; Martini, L.; Messineo, A.; Palla, F.; Rizzi, A.; Savoy-Navarro, A.; Spagnolo, P.; Tenchini, R.; Tonelli, G.; Venturi, A.; Verdini, P. G.; Barone, L.; Cavallari, F.; Cipriani, M.; Del Re, D.; Diemoz, M.; Gelli, S.; Longo, E.; Margaroli, F.; Marzocchi, B.; Meridiani, P.; Organtini, G.; Paramatti, R.; Preiato, F.; Rahatlou, S.; Rovelli, C.; Santanastasio, F.; Amapane, N.; Arcidiacono, R.; Argiro, S.; Arneodo, M.; Bartosik, N.; Bellan, R.; Biino, C.; Cartiglia, N.; Cenna, F.; Costa, M.; Covarelli, R.; Degano, A.; Demaria, N.; Kiani, B.; Mariotti, C.; Maselli, S.; Migliore, E.; Monaco, V.; Monteil, E.; Monteno, M.; Obertino, M. M.; Pacher, L.; Pastrone, N.; Pelliccioni, M.; Pinna Angioni, G. L.; Ravera, F.; Romero, A.; Ruspa, M.; Sacchi, R.; Shchelina, K.; Sola, V.; Solano, A.; Staiano, A.; Traczyk, P.; Belforte, S.; Casarsa, M.; Cossutti, F.; Della Ricca, G.; Zanetti, A.; Kim, D. H.; Kim, G. N.; Kim, M. S.; Lee, J.; Lee, S.; Lee, S. W.; Oh, Y. D.; Sekmen, S.; Son, D. C.; Yang, Y. C.; Lee, A.; Kim, H.; Brochero Cifuentes, J. A.; Kim, T. J.; Cho, S.; Choi, S.; Go, Y.; Gyun, D.; Ha, S.; Hong, B.; Jo, Y.; Kim, Y.; Lee, K.; Lee, K. S.; Lee, S.; Lim, J.; Park, S. K.; Roh, Y.; Almond, J.; Kim, J.; Lee, H.; Oh, S. B.; Radburn-Smith, B. C.; Seo, S. H.; Yang, U. K.; Yoo, H. D.; Yu, G. B.; Choi, M.; Kim, H.; Kim, J. H.; Lee, J. S. H.; Park, I. C.; Ryu, G.; Ryu, M. S.; Choi, Y.; Goh, J.; Hwang, C.; Lee, J.; Yu, I.; Dudenas, V.; Juodagalvis, A.; Vaitkus, J.; Ahmed, I.; Ibrahim, Z. A.; Md Ali, M. A. B.; Mohamad Idris, F.; Wan Abdullah, W. A. T.; Yusli, M. N.; Zolkapli, Z.; Castilla-Valdez, H.; De La Cruz-Burelo, E.; Heredia-De La Cruz, I.; Lopez-Fernandez, R.; Magaña Villalba, R.; Mejia Guisao, J.; Sanchez-Hernandez, A.; Carrillo Moreno, S.; Oropeza Barrera, C.; Vazquez Valencia, F.; Carpinteyro, S.; Pedraza, I.; Salazar Ibarguen, H. A.; Uribe Estrada, C.; Morelos Pineda, A.; Krofcheck, D.; Butler, P. H.; Ahmad, A.; Ahmad, M.; Hassan, Q.; Hoorani, H. R.; Khan, W. A.; Saddique, A.; Shah, M. 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    2017-07-01

    Normalized double-differential cross sections for top quark pair (t\\overline{t}) production are measured in pp collisions at a centre-of-mass energy of 8 {TeV} with the CMS experiment at the LHC. The analyzed data correspond to an integrated luminosity of 19.7 {fb}^{-1}. The measurement is performed in the dilepton e^{± }μ ^{∓ } final state. The t\\overline{t} cross section is determined as a function of various pairs of observables characterizing the kinematics of the top quark and t\\overline{t} system. The data are compared to calculations using perturbative quantum chromodynamics at next-to-leading and approximate next-to-next-to-leading orders. They are also compared to predictions of Monte Carlo event generators that complement fixed-order computations with parton showers, hadronization, and multiple-parton interactions. Overall agreement is observed with the predictions, which is improved when the latest global sets of proton parton distribution functions are used. The inclusion of the measured t\\overline{t} cross sections in a fit of parametrized parton distribution functions is shown to have significant impact on the gluon distribution.

  1. Measurement of double-differential cross sections for top quark pair production in pp collisions at [Formula: see text][Formula: see text] and impact on parton distribution functions.

    PubMed

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Gomez, G; Lopez Virto, A; Marco, J; Martinez Rivero, C; Matorras, F; Piedra Gomez, J; Rodrigo, T; Ruiz-Jimeno, A; Scodellaro, L; Trevisani, N; Vila, I; Vilar Cortabitarte, R; Abbaneo, D; Auffray, E; Auzinger, G; Baillon, P; Ball, A H; Barney, D; Bloch, P; Bocci, A; Botta, C; Camporesi, T; Castello, R; Cepeda, M; Cerminara, G; Chen, Y; Cimmino, A; d'Enterria, D; Dabrowski, A; Daponte, V; David, A; De Gruttola, M; De Roeck, A; Di Marco, E; Dobson, M; Dorney, B; du Pree, T; Duggan, D; Dünser, M; Dupont, N; Elliott-Peisert, A; Everaerts, P; Fartoukh, S; Franzoni, G; Fulcher, J; Funk, W; Gigi, D; Gill, K; Girone, M; Glege, F; Gulhan, D; Gundacker, S; Guthoff, M; Harris, P; Hegeman, J; Innocente, V; Janot, P; Kieseler, J; Kirschenmann, H; Knünz, V; Kornmayer, A; Kortelainen, M J; Krammer, M; Lange, C; Lecoq, P; Lourenço, C; Lucchini, M T; Malgeri, L; Mannelli, M; Martelli, A; Meijers, F; Merlin, J A; Mersi, S; Meschi, E; Milenovic, P; Moortgat, F; Morovic, S; Mulders, M; Neugebauer, H; Orfanelli, S; Orsini, L; Pape, L; Perez, E; Peruzzi, M; Petrilli, A; Petrucciani, G; Pfeiffer, A; Pierini, M; Racz, A; Reis, T; Rolandi, G; Rovere, M; Sakulin, H; Sauvan, J B; Schäfer, C; Schwick, C; Seidel, M; Sharma, A; Silva, P; Sphicas, P; Steggemann, J; Stoye, M; Takahashi, Y; Tosi, M; Treille, D; Triossi, A; Tsirou, A; Veckalns, V; Veres, G I; Verweij, M; Wardle, N; Wöhri, H K; Zagozdzinska, A; Zeuner, W D; Bertl, W; Deiters, K; Erdmann, W; Horisberger, R; Ingram, Q; Kaestli, H C; Kotlinski, D; Langenegger, U; Rohe, T; Wiederkehr, S A; Bachmair, F; Bäni, L; Bianchini, L; Casal, B; Dissertori, G; Dittmar, M; Donegà, M; Grab, C; Heidegger, C; Hits, D; Hoss, J; Kasieczka, G; Lustermann, W; Mangano, B; Marionneau, M; Martinez Ruiz Del Arbol, P; Masciovecchio, M; Meinhard, M T; Meister, D; Micheli, F; Musella, P; Nessi-Tedaldi, F; Pandolfi, F; Pata, J; Pauss, F; Perrin, G; Perrozzi, L; Quittnat, M; Rossini, M; Schönenberger, M; Starodumov, A; Tavolaro, V R; Theofilatos, K; Wallny, R; Aarrestad, T K; Amsler, C; Caminada, L; Canelli, M F; De Cosa, A; Donato, S; Galloni, C; Hinzmann, A; Hreus, T; Kilminster, B; Ngadiuba, J; Pinna, D; Rauco, G; Robmann, P; Salerno, D; Seitz, C; Yang, Y; Zucchetta, A; Candelise, V; Doan, T H; Jain, Sh; Khurana, R; Konyushikhin, M; Kuo, C M; Lin, W; Pozdnyakov, A; Yu, S S; Kumar, Arun; Chang, P; Chang, Y H; Chao, Y; Chen, K F; Chen, P H; Fiori, F; Hou, W-S; Hsiung, Y; Liu, Y F; Lu, R-S; Miñano Moya, M; Paganis, E; Psallidas, A; Tsai, J F; Asavapibhop, B; Singh, G; Srimanobhas, N; Suwonjandee, N; Adiguzel, A; Boran, F; Cerci, S; Damarseckin, S; Demiroglu, Z S; Dozen, C; Dumanoglu, I; Girgis, S; Gokbulut, G; Guler, Y; Hos, I; Kangal, E E; Kara, O; Kiminsu, U; Oglakci, M; Onengut, G; Ozdemir, K; Sunar Cerci, D; Tali, B; Topakli, H; Turkcapar, S; Zorbakir, I S; Zorbilmez, C; Bilin, B; Bilmis, S; Isildak, B; Karapinar, G; Yalvac, M; Zeyrek, M; Gülmez, E; Kaya, M; Kaya, O; Yetkin, E A; Yetkin, T; Cakir, A; Cankocak, K; Sen, S; Grynyov, B; Levchuk, L; Sorokin, P; Aggleton, R; Ball, F; Beck, L; Brooke, J J; Burns, D; Clement, E; Cussans, D; Flacher, H; Goldstein, J; Grimes, M; Heath, G P; Heath, H F; Jacob, J; Kreczko, L; Lucas, C; Newbold, D M; Paramesvaran, S; Poll, A; Sakuma, T; Seif El Nasr-Storey, S; Smith, D; Smith, V J; Bell, K W; Belyaev, A; Brew, C; Brown, R M; Calligaris, L; Cieri, D; Cockerill, D J A; Coughlan, J A; Harder, K; Harper, S; Olaiya, E; Petyt, D; Shepherd-Themistocleous, C H; Thea, A; Tomalin, I R; Williams, T; Baber, M; Bainbridge, R; Buchmuller, O; Bundock, A; Casasso, S; Citron, M; Colling, D; Corpe, L; Dauncey, P; Davies, G; De Wit, A; Della Negra, M; Di Maria, R; Dunne, P; Elwood, A; Futyan, D; Haddad, Y; Hall, G; Iles, G; James, T; Lane, R; Laner, C; Lyons, L; Magnan, A-M; Malik, S; Mastrolorenzo, L; Nash, J; Nikitenko, A; Pela, J; Penning, B; Pesaresi, M; Raymond, D M; Richards, A; Rose, A; Scott, E; Seez, C; Summers, S; Tapper, A; Uchida, K; Vazquez Acosta, M; Virdee, T; Wright, J; Zenz, S C; Cole, J E; Hobson, P R; Khan, A; Kyberd, P; Reid, I D; Symonds, P; Teodorescu, L; Turner, M; Borzou, A; Call, K; Dittmann, J; Hatakeyama, K; Liu, H; Pastika, N; Bartek, R; Dominguez, A; Buccilli, A; Cooper, S I; Henderson, C; Rumerio, P; West, C; Arcaro, D; Avetisyan, A; Bose, T; Gastler, D; Rankin, D; Richardson, C; Rohlf, J; Sulak, L; Zou, D; Benelli, G; Cutts, D; Garabedian, A; Hakala, J; Heintz, U; Hogan, J M; Jesus, O; Kwok, K H M; Laird, E; Landsberg, G; Mao, Z; Narain, M; Piperov, S; Sagir, S; Spencer, E; Syarif, R; Breedon, R; Burns, D; Calderon De La Barca Sanchez, M; Chauhan, S; Chertok, M; Conway, J; Conway, R; Cox, P T; Erbacher, R; Flores, C; Funk, G; Gardner, M; Ko, W; Lander, R; Mclean, C; Mulhearn, M; Pellett, D; Pilot, J; Shalhout, S; Shi, M; Smith, J; Squires, M; Stolp, D; Tos, K; Tripathi, M; Bachtis, M; Bravo, C; Cousins, R; Dasgupta, A; Florent, A; Hauser, J; Ignatenko, M; Mccoll, N; Saltzberg, D; Schnaible, C; Valuev, V; Weber, M; Bouvier, E; Burt, K; Clare, R; Ellison, J; Gary, J W; Ghiasi Shirazi, S M A; Hanson, G; Heilman, J; Jandir, P; Kennedy, E; Lacroix, F; Long, O R; Olmedo Negrete, M; Paneva, M I; Shrinivas, A; Si, W; Wei, H; Wimpenny, S; Yates, B R; Branson, J G; Cerati, G B; Cittolin, S; Derdzinski, M; Gerosa, R; Holzner, A; Klein, D; Krutelyov, V; Letts, J; Macneill, I; Olivito, D; Padhi, S; Pieri, M; Sani, M; Sharma, V; Simon, S; Tadel, M; Vartak, A; Wasserbaech, S; Welke, C; Wood, J; Würthwein, F; Yagil, A; Zevi Della Porta, G; Amin, N; Bhandari, R; Bradmiller-Feld, J; Campagnari, C; Dishaw, A; Dutta, V; Franco Sevilla, M; George, C; Golf, F; Gouskos, L; Gran, J; Heller, R; Incandela, J; Mullin, S D; Ovcharova, A; Qu, H; Richman, J; Stuart, D; Suarez, I; Yoo, J; Anderson, D; Bendavid, J; Bornheim, A; Bunn, J; Duarte, J; Lawhorn, J M; Mott, A; Newman, H B; Pena, C; Spiropulu, M; Vlimant, J R; Xie, S; Zhu, R Y; Andrews, M B; Ferguson, T; Paulini, M; Russ, J; Sun, M; Vogel, H; Vorobiev, I; Weinberg, M; Cumalat, J P; Ford, W T; Jensen, F; Johnson, A; Krohn, M; Leontsinis, S; Mulholland, T; Stenson, K; Wagner, S R; Alexander, J; Chaves, J; Chu, J; Dittmer, S; Mcdermott, K; Mirman, N; Patterson, J R; Rinkevicius, A; Ryd, A; Skinnari, L; Soffi, L; Tan, S M; Tao, Z; Thom, J; Tucker, J; Wittich, P; Zientek, M; Winn, D; Abdullin, S; Albrow, M; Apollinari, G; Apresyan, A; Banerjee, S; Bauerdick, L A T; Beretvas, A; Berryhill, J; Bhat, P C; Bolla, G; Burkett, K; Butler, J N; Cheung, H W K; Chlebana, F; Cihangir, S; Cremonesi, M; Elvira, V D; Fisk, I; Freeman, J; Gottschalk, E; Gray, L; Green, D; Grünendahl, S; Gutsche, O; Hare, D; Harris, R M; Hasegawa, S; Hirschauer, J; Hu, Z; Jayatilaka, B; Jindariani, S; Johnson, M; Joshi, U; Klima, B; Kreis, B; Lammel, S; Linacre, J; Lincoln, D; Lipton, R; Liu, M; Liu, T; Lopes De Sá, R; Lykken, J; Maeshima, K; Magini, N; Marraffino, J M; Maruyama, S; Mason, D; McBride, P; Merkel, P; Mrenna, S; Nahn, S; O'Dell, V; Pedro, K; Prokofyev, O; Rakness, G; Ristori, L; Sexton-Kennedy, E; Soha, A; Spalding, W J; Spiegel, L; Stoynev, S; Strait, J; Strobbe, N; Taylor, L; Tkaczyk, S; Tran, N V; Uplegger, L; Vaandering, E W; Vernieri, C; Verzocchi, M; Vidal, R; Wang, M; Weber, H A; Whitbeck, A; Wu, Y; Acosta, D; Avery, P; Bortignon, P; Bourilkov, D; Brinkerhoff, A; Carnes, A; Carver, M; Curry, D; Das, S; Field, R D; Furic, I K; Konigsberg, J; Korytov, A; Low, J F; Ma, P; Matchev, K; Mei, H; Mitselmakher, G; Rank, D; Shchutska, L; Sperka, D; Thomas, L; Wang, J; Wang, S; Yelton, J; Linn, S; Markowitz, P; Martinez, G; Rodriguez, J L; Ackert, A; Adams, T; Askew, A; Bein, S; Hagopian, S; Hagopian, V; Johnson, K F; Kolberg, T; Perry, T; Prosper, H; Santra, A; Yohay, R; Baarmand, M M; Bhopatkar, V; Colafranceschi, S; Hohlmann, M; Noonan, D; Roy, T; Yumiceva, F; Adams, M R; Apanasevich, L; Berry, D; Betts, R R; Cavanaugh, R; Chen, X; Evdokimov, O; Gerber, C E; Hangal, D A; Hofman, D J; Jung, K; Kamin, J; Sandoval Gonzalez, I D; Trauger, H; Varelas, N; Wang, H; Wu, Z; Zhang, J; Bilki, B; Clarida, W; Dilsiz, K; Durgut, S; Gandrajula, R P; Haytmyradov, M; Khristenko, V; Merlo, J-P; Mermerkaya, H; Mestvirishvili, A; Moeller, A; Nachtman, J; Ogul, H; Onel, Y; Ozok, F; Penzo, A; Snyder, C; Tiras, E; Wetzel, J; Yi, K; Blumenfeld, B; Cocoros, A; Eminizer, N; Fehling, D; Feng, L; Gritsan, A V; Maksimovic, P; Roskes, J; Sarica, U; Swartz, M; Xiao, M; You, C; Al-Bataineh, A; Baringer, P; Bean, A; Boren, S; Bowen, J; Castle, J; Forthomme, L; Khalil, S; Kropivnitskaya, A; Majumder, D; Mcbrayer, W; Murray, M; Sanders, S; Stringer, R; Tapia Takaki, J D; Wang, Q; Ivanov, A; Kaadze, K; Maravin, Y; Mohammadi, A; Saini, L K; Skhirtladze, N; Toda, S; Rebassoo, F; Wright, D; Anelli, C; Baden, A; Baron, O; Belloni, A; Calvert, B; Eno, S C; Ferraioli, C; Gomez, J A; Hadley, N J; Jabeen, S; Jeng, G Y; Kellogg, R G; Kunkle, J; Mignerey, A C; Ricci-Tam, F; Shin, Y H; Skuja, A; Tonjes, M B; Tonwar, S C; Abercrombie, D; Allen, B; Apyan, A; Azzolini, V; Barbieri, R; Baty, A; Bi, R; Bierwagen, K; Brandt, S; Busza, W; Cali, I A; D'Alfonso, M; Demiragli, Z; Gomez Ceballos, G; Goncharov, M; Hsu, D; Iiyama, Y; Innocenti, G M; Klute, M; Kovalskyi, D; Krajczar, K; Lai, Y S; Lee, Y-J; Levin, A; Luckey, P D; Maier, B; Marini, A C; Mcginn, C; Mironov, C; Narayanan, S; Niu, X; Paus, C; Roland, C; Roland, G; Salfeld-Nebgen, J; Stephans, G S F; Tatar, K; Velicanu, D; Wang, J; Wang, T W; Wyslouch, B; Benvenuti, A C; Chatterjee, R M; Evans, A; Hansen, P; Kalafut, S; Kao, S C; Kubota, Y; Lesko, Z; Mans, J; Nourbakhsh, S; Ruckstuhl, N; Rusack, R; Tambe, N; Turkewitz, J; Acosta, J G; Oliveros, S; Avdeeva, E; Bloom, K; Claes, D R; Fangmeier, C; Gonzalez Suarez, R; Kamalieddin, R; Kravchenko, I; Malta Rodrigues, A; Monroy, J; Siado, J E; Snow, G R; Stieger, B; Alyari, M; Dolen, J; Godshalk, A; Harrington, C; Iashvili, I; Kaisen, J; Nguyen, D; Parker, A; Rappoccio, S; Roozbahani, B; Alverson, G; Barberis, E; Hortiangtham, A; Massironi, A; Morse, D M; Nash, D; Orimoto, T; Teixeira De Lima, R; Trocino, D; Wang, R-J; Wood, D; Bhattacharya, S; Charaf, O; Hahn, K A; Mucia, N; Odell, N; Pollack, B; Schmitt, M H; Sung, K; Trovato, M; Velasco, M; Dev, N; Hildreth, M; Hurtado Anampa, K; Jessop, C; Karmgard, D J; Kellams, N; Lannon, K; Marinelli, N; Meng, F; Mueller, C; Musienko, Y; Planer, M; Reinsvold, A; Ruchti, R; Rupprecht, N; Smith, G; Taroni, S; Wayne, M; Wolf, M; Woodard, A; Alimena, J; Antonelli, L; Bylsma, B; Durkin, L S; Flowers, S; Francis, B; Hart, A; Hill, C; Ji, W; Liu, B; Luo, W; Puigh, D; Winer, B L; Wulsin, H W; Cooperstein, S; Driga, O; Elmer, P; Hardenbrook, J; Hebda, P; Lange, D; Luo, J; Marlow, D; Medvedeva, T; Mei, K; Ojalvo, I; Olsen, J; Palmer, C; Piroué, P; Stickland, D; Svyatkovskiy, A; Tully, C; Malik, S; Barker, A; Barnes, V E; Folgueras, S; Gutay, L; Jha, M K; Jones, M; Jung, A W; Khatiwada, A; Miller, D H; Neumeister, N; Schulte, J F; Shi, X; Sun, J; Wang, F; Xie, W; Parashar, N; Stupak, J; Adair, A; Akgun, B; Chen, Z; Ecklund, K M; Geurts, F J M; Guilbaud, M; Li, W; Michlin, B; Northup, M; Padley, B P; Roberts, J; Rorie, J; Tu, Z; Zabel, J; Betchart, B; Bodek, A; de Barbaro, P; Demina, R; Duh, Y T; Ferbel, T; Galanti, M; Garcia-Bellido, A; Han, J; Hindrichs, O; Khukhunaishvili, A; Lo, K H; Tan, P; Verzetti, M; Agapitos, A; Chou, J P; Gershtein, Y; Gómez Espinosa, T A; Halkiadakis, E; Heindl, M; Hughes, E; Kaplan, S; Kunnawalkam Elayavalli, R; Kyriacou, S; Lath, A; Montalvo, R; Nash, K; Osherson, M; Saka, H; Salur, S; Schnetzer, S; Sheffield, D; Somalwar, S; Stone, R; Thomas, S; Thomassen, P; Walker, M; Delannoy, A G; Foerster, M; Heideman, J; Riley, G; Rose, K; Spanier, S; Thapa, K; Bouhali, O; Celik, A; Dalchenko, M; De Mattia, M; Delgado, A; Dildick, S; Eusebi, R; Gilmore, J; Huang, T; Juska, E; Kamon, T; Mueller, R; Pakhotin, Y; Patel, R; Perloff, A; Perniè, L; Rathjens, D; Safonov, A; Tatarinov, A; Ulmer, K A; Akchurin, N; Damgov, J; De Guio, F; Dragoiu, C; Dudero, P R; Faulkner, J; Gurpinar, E; Kunori, S; Lamichhane, K; Lee, S W; Libeiro, T; Peltola, T; Undleeb, S; Volobouev, I; Wang, Z; Greene, S; Gurrola, A; Janjam, R; Johns, W; Maguire, C; Melo, A; Ni, H; Sheldon, P; Tuo, S; Velkovska, J; Xu, Q; Arenton, M W; Barria, P; Cox, B; Hirosky, R; Ledovskoy, A; Li, H; Neu, C; Sinthuprasith, T; Sun, X; Wang, Y; Wolfe, E; Xia, F; Clarke, C; Harr, R; Karchin, P E; Sturdy, J; Zaleski, S; Belknap, D A; Buchanan, J; Caillol, C; Dasu, S; Dodd, L; Duric, S; Gomber, B; Grothe, M; Herndon, M; Hervé, A; Hussain, U; Klabbers, P; Lanaro, A; Levine, A; Long, K; Loveless, R; Pierro, G A; Polese, G; Ruggles, T; Savin, A; Smith, N; Smith, W H; Taylor, D; Woods, N

    2017-01-01

    Normalized double-differential cross sections for top quark pair ([Formula: see text]) production are measured in pp collisions at a centre-of-mass energy of 8[Formula: see text] with the CMS experiment at the LHC. The analyzed data correspond to an integrated luminosity of 19.7[Formula: see text]. The measurement is performed in the dilepton [Formula: see text] final state. The [Formula: see text] cross section is determined as a function of various pairs of observables characterizing the kinematics of the top quark and [Formula: see text] system. The data are compared to calculations using perturbative quantum chromodynamics at next-to-leading and approximate next-to-next-to-leading orders. They are also compared to predictions of Monte Carlo event generators that complement fixed-order computations with parton showers, hadronization, and multiple-parton interactions. Overall agreement is observed with the predictions, which is improved when the latest global sets of proton parton distribution functions are used. The inclusion of the measured [Formula: see text] cross sections in a fit of parametrized parton distribution functions is shown to have significant impact on the gluon distribution.

  2. Bounding the Higgs boson width through interferometry.

    PubMed

    Dixon, Lance J; Li, Ye

    2013-09-13

    We study the change in the diphoton-invariant-mass distribution for Higgs boson decays to two photons, due to interference between the Higgs resonance in gluon fusion and the continuum background amplitude for gg→γγ. Previously, the apparent Higgs mass was found to shift by around 100 MeV in the standard model in the leading-order approximation, which may potentially be experimentally observable. We compute the next-to-leading-order QCD corrections to the apparent mass shift, which reduce it by about 40%. The apparent mass shift may provide a way to measure, or at least bound, the Higgs boson width at the Large Hadron Collider through "interferometry." We investigate how the shift depends on the Higgs width, in a model that maintains constant Higgs boson signal yields. At Higgs widths above 30 MeV, the mass shift is over 200 MeV and increases with the square root of the width. The apparent mass shift could be measured by comparing with the ZZ* channel, where the shift is much smaller. It might be possible to measure the shift more accurately by exploiting its strong dependence on the Higgs transverse momentum.

  3. A proposal of a local modified QCD

    NASA Astrophysics Data System (ADS)

    Cabo Montes de Oca, A.

    2012-06-01

    A local and renormalizable version of a modified PQCD introduced in previous works is presented. The construction indicates that it could be equivalent to massless QCD. The case in which only quark condensate effects are retained is discussed in more detail. Then, the appearing auxiliary fermion fields can be integrated, leading to a theory with the action of massless QCD, to which one local and gauge invariant Lagrangian term for each quark flavour is added. Those action terms are defined by two gluon and two quark fields, in a form curiously not harming power counting renormalizability. The gluon self-energy is evaluated in second order in the gauge coupling and all orders in the new quark couplings, and the result became transversal as required by the gauge invariance. The vacuum energy was also calculated in the two-loop approximation and became gauge parameter independent. The possibilities that higher-loop contributions to the vacuum energy allow the generation of a quark mass hierarchy as a flavour symmetry-breaking effect are commented. The decision on this issue needs a further evaluation of more than two-loop contributions, in which more than one type of quark loops start appearing, possibly leading to interference effects in the vacuum energy.

  4. Heavy quarkonium suppression in a fireball

    NASA Astrophysics Data System (ADS)

    Brambilla, Nora; Escobedo, Miguel A.; Soto, Joan; Vairo, Antonio

    2018-04-01

    We perform a comprehensive study of the time evolution of heavy-quarkonium states in an expanding hot QCD medium by implementing effective field theory techniques in the framework of open quantum systems. The formalism incorporates quarkonium production and its subsequent evolution in the fireball including quarkonium dissociation and recombination. We consider a fireball with a local temperature that is much smaller than the inverse size of the quarkonium and much larger than its binding energy. The calculation is performed at an accuracy that is leading order in the heavy-quark density expansion and next-to-leading order in the multipole expansion. Within this accuracy, for a smooth variation of the temperature and large times, the evolution equation can be written as a Lindblad equation. We solve the Lindblad equation numerically both for a weakly coupled quark-gluon plasma and a strongly coupled medium. As an application, we compute the nuclear modification factor for the ϒ (1 S ) and ϒ (2 S ) states. We also consider the case of static quarks, which can be solved analytically. Our study fulfills three essential conditions: it conserves the total number of heavy quarks, it accounts for the non-Abelian nature of QCD, and it avoids classical approximations.

  5. Small parameters in infrared quantum chromodynamics

    NASA Astrophysics Data System (ADS)

    Peláez, Marcela; Reinosa, Urko; Serreau, Julien; Tissier, Matthieu; Wschebor, Nicolás

    2017-12-01

    We study the long-distance properties of quantum chromodynamics in the Landau gauge in an expansion in powers of the three-gluon, four-gluon, and ghost-gluon couplings, but without expanding in the quark-gluon coupling. This is motivated by two observations. First, the gauge sector is well described by perturbation theory in the context of a phenomenological model with a massive gluon. Second, the quark-gluon coupling is significantly larger than those in the gauge sector at large distances. In order to resum the contributions of the remaining infinite set of QED-like diagrams, we further expand the theory in 1 /Nc, where Nc is the number of colors. At leading order, this double expansion leads to the well-known rainbow approximation for the quark propagator. We take advantage of the systematic expansion to get a renormalization-group improvement of the rainbow resummation. A simple numerical solution of the resulting coupled set of equations reproduces the phenomenology of the spontaneous chiral symmetry breaking: for sufficiently large quark-gluon coupling constant, the constituent quark mass saturates when its valence mass approaches zero. We find very good agreement with lattice data for the scalar part of the propagator and explain why the vectorial part is poorly reproduced.

  6. CGC factorization for forward particle production in proton-nucleus collisions at next-to-leading order

    DOE PAGES

    Iancu, E.; Mueller, A. H.; Triantafyllopoulos, D. N.

    2016-12-13

    Within the Color Glass Condensate effective theory, we reconsider the next-to-leading order (NLO) calculation of the single inclusive particle production at forward rapidities in proton-nucleus collisions at high energy. Focusing on quark production for definiteness, we establish a new factorization scheme, perturbatively correct through NLO, in which there is no ‘rapidity subtraction’. That is, the NLO correction to the impact factor is not explicitly separated from the high-energy evolution. Our construction exploits the skeleton structure of the (NLO) Balitsky-Kovchegov equation, in which the first step of the evolution is explicitly singled out. The NLO impact factor is included by computingmore » this first emission with the exact kinematics for the emitted gluon, rather than by using the eikonal approximation. This particular calculation has already been presented in the literature, but the reorganization of the perturbation theory that we propose is new. As compared to the proposal in, our scheme is free of the fine-tuning inherent in the rapidity subtraction, which might be the origin of the negativity of the NLO cross-section observed in previous studies.« less

  7. An Extension of the Krieger-Li-Iafrate Approximation to the Optimized-Effective-Potential Method

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Wilson, B.G.

    1999-11-11

    The Krieger-Li-Iafrate approximation can be expressed as the zeroth order result of an unstable iterative method for solving the integral equation form of the optimized-effective-potential method. By pre-conditioning the iterate a first order correction can be obtained which recovers the bulk of quantal oscillations missing in the zeroth order approximation. A comparison of calculated total energies are given with Krieger-Li-Iafrate, Local Density Functional, and Hyper-Hartree-Fock results for non-relativistic atoms and ions.

  8. An analytical technique for approximating unsteady aerodynamics in the time domain

    NASA Technical Reports Server (NTRS)

    Dunn, H. J.

    1980-01-01

    An analytical technique is presented for approximating unsteady aerodynamic forces in the time domain. The order of elements of a matrix Pade approximation was postulated, and the resulting polynomial coefficients were determined through a combination of least squares estimates for the numerator coefficients and a constrained gradient search for the denominator coefficients which insures stable approximating functions. The number of differential equations required to represent the aerodynamic forces to a given accuracy tends to be smaller than that employed in certain existing techniques where the denominator coefficients are chosen a priori. Results are shown for an aeroelastic, cantilevered, semispan wing which indicate a good fit to the aerodynamic forces for oscillatory motion can be achieved with a matrix Pade approximation having fourth order numerator and second order denominator polynomials.

  9. The use of fractional orders in the determination of birefringence of highly dispersive materials by the channelled spectrum method

    NASA Astrophysics Data System (ADS)

    Nagarajan, K.; Shashidharan Nair, C. K.

    2007-07-01

    The channelled spectrum employing polarized light interference is a very convenient method for the study of dispersion of birefringence. However, while using this method, the absolute order of the polarized light interference fringes cannot be determined easily. Approximate methods are therefore used to estimate the order. One of the approximations is that the dispersion of birefringence across neighbouring integer order fringes is negligible. In this paper, we show how this approximation can cause errors. A modification is reported whereby the error in the determination of absolute fringe order can be reduced using fractional orders instead of integer orders. The theoretical background for this method supported with computer simulation is presented. An experimental arrangement implementing these modifications is described. This method uses a Constant Deviation Spectrometer (CDS) and a Soleil Babinet Compensator (SBC).

  10. Testing higher-order Lagrangian perturbation theory against numerical simulation. 1: Pancake models

    NASA Technical Reports Server (NTRS)

    Buchert, T.; Melott, A. L.; Weiss, A. G.

    1993-01-01

    We present results showing an improvement of the accuracy of perturbation theory as applied to cosmological structure formation for a useful range of quasi-linear scales. The Lagrangian theory of gravitational instability of an Einstein-de Sitter dust cosmogony investigated and solved up to the third order is compared with numerical simulations. In this paper we study the dynamics of pancake models as a first step. In previous work the accuracy of several analytical approximations for the modeling of large-scale structure in the mildly non-linear regime was analyzed in the same way, allowing for direct comparison of the accuracy of various approximations. In particular, the Zel'dovich approximation (hereafter ZA) as a subclass of the first-order Lagrangian perturbation solutions was found to provide an excellent approximation to the density field in the mildly non-linear regime (i.e. up to a linear r.m.s. density contrast of sigma is approximately 2). The performance of ZA in hierarchical clustering models can be greatly improved by truncating the initial power spectrum (smoothing the initial data). We here explore whether this approximation can be further improved with higher-order corrections in the displacement mapping from homogeneity. We study a single pancake model (truncated power-spectrum with power-spectrum with power-index n = -1) using cross-correlation statistics employed in previous work. We found that for all statistical methods used the higher-order corrections improve the results obtained for the first-order solution up to the stage when sigma (linear theory) is approximately 1. While this improvement can be seen for all spatial scales, later stages retain this feature only above a certain scale which is increasing with time. However, third-order is not much improvement over second-order at any stage. The total breakdown of the perturbation approach is observed at the stage, where sigma (linear theory) is approximately 2, which corresponds to the onset of hierarchical clustering. This success is found at a considerable higher non-linearity than is usual for perturbation theory. Whether a truncation of the initial power-spectrum in hierarchical models retains this improvement will be analyzed in a forthcoming work.

  11. Top-pair production at hadron colliders with next-to-next-to-leading logarithmic soft-gluon resummation

    NASA Astrophysics Data System (ADS)

    Cacciari, Matteo; Czakon, Michał; Mangano, Michelangelo; Mitov, Alexander; Nason, Paolo

    2012-04-01

    Incorporating all recent theoretical advances, we resum soft-gluon corrections to the total ttbar cross-section at hadron colliders at the next-to-next-to-leading logarithmic (NNLL) order. We perform the resummation in the well established framework of Mellin N-space resummation. We exhaustively study the sources of systematic uncertainty like renormalization and factorization scale variation, power suppressed effects and missing two- and higher-loop corrections. The inclusion of soft-gluon resummation at NNLL brings only a minor decrease in the perturbative uncertainty with respect to the NLL approximation, and a small shift in the central value, consistent with the quoted uncertainties. These numerical predictions agree with the currently available measurements from the Tevatron and LHC and have uncertainty of similar size. We conclude that significant improvements in the ttbar cross-sections can potentially be expected only upon inclusion of the complete NNLO corrections.

  12. On the synchrotron radiation reaction in external magnetic field

    NASA Astrophysics Data System (ADS)

    Tursunov, Arman; Kološ, Martin

    2017-12-01

    We study the dynamics of point electric charges undergoing radiation reaction force due to synchrotron radiation in the presence of external uniform magnetic field. The radiation reaction force cannot be neglected in many physical situations and its presence modifies the equations of motion significantly. The exact form of the equation of motion known as the Lorentz-Dirac equation contains higher order Schott term which leads to the appearance of the runaway solutions. We demonstrate effective computational ways to avoid such unphysical solutions and perform numerical integration of the dynamical equations. We show that in the ultrarelativistic case the Schott term is small and does not have considerable effect to the trajectory of a particle. We compare results with the covariant Landau-Lifshitz equation which is the first iteration of the Lorentz-Dirac equation. Even though the Landau-Lifshitz equation is thought to be approximative solution, we show that in realistic scenarios both approaches lead to identical results.

  13. Thermal damage produced by high-irradiance continuous wave CO2 laser cutting of tissue.

    PubMed

    Schomacker, K T; Walsh, J T; Flotte, T J; Deutsch, T F

    1990-01-01

    Thermal damage produced by continuous wave (cw) CO2 laser ablation of tissue in vitro was measured for irradiances ranging from 360 W/cm2 to 740 kW/cm2 in order to investigate the extent to which ablative cooling can limit tissue damage. Damage zones thinner than 100 microns were readily produced using single pulses to cut guinea pig skin as well as bovine cornea, aorta, and myocardium. Multiple pulses can lead to increased damage. However, a systematic decrease in damage with irradiance, predicted theoretically by an evaporation model of ablation, was not observed. The damage-zone thickness was approximately constant around the periphery of the cut, consistent with the existence of a liquid layer which stores heat and leads to tissue damage, and with a model of damage and ablation recently proposed by Zweig et al.

  14. Particle physics catalysis of thermal big bang nucleosynthesis.

    PubMed

    Pospelov, Maxim

    2007-06-08

    We point out that the existence of metastable, tau>10(3) s, negatively charged electroweak-scale particles (X-) alters the predictions for lithium and other primordial elemental abundances for A>4 via the formation of bound states with nuclei during big bang nucleosynthesis. In particular, we show that the bound states of X- with helium, formed at temperatures of about T=10(8) K, lead to the catalytic enhancement of 6Li production, which is 8 orders of magnitude more efficient than the standard channel. In particle physics models where subsequent decay of X- does not lead to large nonthermal big bang nucleosynthesis effects, this directly translates to the level of sensitivity to the number density of long-lived X- particles (tau>10(5) s) relative to entropy of nX-/s less, approximately <3x10(-17), which is one of the most stringent probes of electroweak scale remnants known to date.

  15. Doppler tracking in time-dependent cosmological spacetimes

    NASA Astrophysics Data System (ADS)

    Giulini, Domenico; Carrera, Matteo

    I will discuss the theoretical problems associated with Doppler tracking in time dependent background geometries, where ordinary Newtonian kinematics fails. A derivation of an exact general-relativistic formula for the two-way Doppler tracking of a spacecraft in homogeneous and isotropic Friedmann-Lemaitre-Robertson-Walker (FLRW) spacetimes is presented, as well as a controlled approximation in McVittie spacetimes representing an FLRW background with a single spherically-symmetric inhomogeneity (e.g. a single star or black hole). The leading-order corrections of the acceleration as compared to the Newtonian expression are calculated, which are due to retardation and cosmological expansion and which in the Solar System turn out to be significantly below the scale (nanometer per square-second) set by the Pioneer Anomaly. Last, but not least, I discuss kinematical ambiguities connected with notions of "simultaneity" and "spatial distance", which, in principle, also lead to tracking corrections.

  16. Pseudospectral collocation methods for fourth order differential equations

    NASA Technical Reports Server (NTRS)

    Malek, Alaeddin; Phillips, Timothy N.

    1994-01-01

    Collocation schemes are presented for solving linear fourth order differential equations in one and two dimensions. The variational formulation of the model fourth order problem is discretized by approximating the integrals by a Gaussian quadrature rule generalized to include the values of the derivative of the integrand at the boundary points. Collocation schemes are derived which are equivalent to this discrete variational problem. An efficient preconditioner based on a low-order finite difference approximation to the same differential operator is presented. The corresponding multidomain problem is also considered and interface conditions are derived. Pseudospectral approximations which are C1 continuous at the interfaces are used in each subdomain to approximate the solution. The approximations are also shown to be C3 continuous at the interfaces asymptotically. A complete analysis of the collocation scheme for the multidomain problem is provided. The extension of the method to the biharmonic equation in two dimensions is discussed and results are presented for a problem defined in a nonrectangular domain.

  17. Mode Reduction and Upscaling of Reactive Transport Under Incomplete Mixing

    NASA Astrophysics Data System (ADS)

    Lester, D. R.; Bandopadhyay, A.; Dentz, M.; Le Borgne, T.

    2016-12-01

    Upscaling of chemical reactions in partially-mixed fluid environments is a challenging problem due to the detailed interactions between inherently nonlinear reaction kinetics and complex spatio-temporal concentration distributions under incomplete mixing. We address this challenge via the development of an order reduction method for the advection-diffusion-reaction equation (ADRE) via projection of the reaction kinetics onto a small number N of leading eigenmodes of the advection-diffusion operator (the so-called "strange eigenmodes" of the flow) as an N-by-N nonlinear system, whilst mixing dynamics only are projected onto the remaining modes. For simple kinetics and moderate Péclet and Damkhöler numbers, this approach yields analytic solutions for the concentration mean, evolving spatio-temporal distribution and PDF in terms of the well-mixed reaction kinetics and mixing dynamics. For more complex kinetics or large Péclet or Damkhöler numbers only a small number of modes are required to accurately quantify the mixing and reaction dynamics in terms of the concentration field and PDF, facilitating greatly simplified approximation and analysis of reactive transport. Approximate solutions of this low-order nonlinear system provide quantiative predictions of the evolving concentration PDF. We demonstrate application of this method to a simple random flow and various mass-action reaction kinetics.

  18. Exploratory analysis regarding the domain definitions for computer based analytical models

    NASA Astrophysics Data System (ADS)

    Raicu, A.; Oanta, E.; Barhalescu, M.

    2017-08-01

    Our previous computer based studies dedicated to structural problems using analytical methods defined the composite cross section of a beam as a result of Boolean operations with so-called ‘simple’ shapes. Using generalisations, in the class of the ‘simple’ shapes were included areas bounded by curves approximated using spline functions and areas approximated as polygons. However, particular definitions lead to particular solutions. In order to ascend above the actual limitations, we conceived a general definition of the cross sections that are considered now calculus domains consisting of several subdomains. The according set of input data use complex parameterizations. This new vision allows us to naturally assign a general number of attributes to the subdomains. In this way there may be modelled new phenomena that use map-wise information, such as the metal alloys equilibrium diagrams. The hierarchy of the input data text files that use the comma-separated-value format and their structure are also presented and discussed in the paper. This new approach allows us to reuse the concepts and part of the data processing software instruments already developed. The according software to be subsequently developed will be modularised and generalised in order to be used in the upcoming projects that require rapid development of computer based models.

  19. DEMNUni: massive neutrinos and the bispectrum of large scale structures

    NASA Astrophysics Data System (ADS)

    Ruggeri, Rossana; Castorina, Emanuele; Carbone, Carmelita; Sefusatti, Emiliano

    2018-03-01

    The main effect of massive neutrinos on the large-scale structure consists in a few percent suppression of matter perturbations on all scales below their free-streaming scale. Such effect is of particular importance as it allows to constraint the value of the sum of neutrino masses from measurements of the galaxy power spectrum. In this work, we present the first measurements of the next higher-order correlation function, the bispectrum, from N-body simulations that include massive neutrinos as particles. This is the simplest statistics characterising the non-Gaussian properties of the matter and dark matter halos distributions. We investigate, in the first place, the suppression due to massive neutrinos on the matter bispectrum, comparing our measurements with the simplest perturbation theory predictions, finding the approximation of neutrinos contributing at quadratic order in perturbation theory to provide a good fit to the measurements in the simulations. On the other hand, as expected, a linear approximation for neutrino perturbations would lead to Script O(fν) errors on the total matter bispectrum at large scales. We then attempt an extension of previous results on the universality of linear halo bias in neutrino cosmologies, to non-linear and non-local corrections finding consistent results with the power spectrum analysis.

  20. The three-point function as a probe of models for large-scale structure

    NASA Astrophysics Data System (ADS)

    Frieman, Joshua A.; Gaztanaga, Enrique

    1994-04-01

    We analyze the consequences of models of structure formation for higher order (n-point) galaxy correlation functions in the mildly nonlinear regime. Several variations of the standard Omega = 1 cold dark matter model with scale-invariant primordial perturbations have recently been introduced to obtain more power on large scales, Rp is approximately 20/h Mpc, e.g., low matter-density (nonzero cosmological constant) models, 'tilted' primordial spectra, and scenarios with a mixture of cold and hot dark matter. They also include models with an effective scale-dependent bias, such as the cooperative galaxy formation scenario of Bower et al. We show that higher-order (n-point) galaxy correlation functions can provide a useful test of such models and can discriminate between models with true large-scale power in the density field and those where the galaxy power arises from scale-dependent bias: a bias with rapid scale dependence leads to a dramatic decrease of the the hierarchical amplitudes QJ at large scales, r is greater than or approximately Rp. Current observational constraints on the three-point amplitudes Q3 and S3 can place limits on the bias parameter(s) and appear to disfavor, but not yet rule out, the hypothesis that scale-dependent bias is responsible for the extra power observed on large scales.

  1. Ionization energies and electron affinities from a random-phase-approximation many-body Green's-function method including exchange interactions

    NASA Astrophysics Data System (ADS)

    Heßelmann, Andreas

    2017-06-01

    A many-body Green's-function method employing an infinite order summation of ring and exchange-ring contributions to the self-energy is presented. The individual correlation and relaxation contributions to the quasiparticle energies are calculated using an iterative scheme which utilizes density fitting of the particle-hole, particle-particle and hole-hole densities. It is shown that the ionization energies and electron affinities of this approach agree better with highly accurate coupled-cluster singles and doubles with perturbative triples energy difference results than those obtained with second-order Green's-function approaches. An analysis of the correlation and relaxation terms of the self-energy for the direct- and exchange-random-phase-approximation (RPA) Green's-function methods shows that the inclusion of exchange interactions leads to a reduction of the two contributions in magnitude. These differences, however, strongly cancel each other when summing the individual terms to the quasiparticle energies. Due to this, the direct- and exchange-RPA methods perform similarly for the description of ionization energies (IPs) and electron affinities (EAs). The coupled-cluster reference IPs and EAs, if corrected to the adiabatic energy differences between the neutral and charged molecules, were shown to be in very good agreement with experimental measurements.

  2. Lognormal Approximations of Fault Tree Uncertainty Distributions.

    PubMed

    El-Shanawany, Ashraf Ben; Ardron, Keith H; Walker, Simon P

    2018-01-26

    Fault trees are used in reliability modeling to create logical models of fault combinations that can lead to undesirable events. The output of a fault tree analysis (the top event probability) is expressed in terms of the failure probabilities of basic events that are input to the model. Typically, the basic event probabilities are not known exactly, but are modeled as probability distributions: therefore, the top event probability is also represented as an uncertainty distribution. Monte Carlo methods are generally used for evaluating the uncertainty distribution, but such calculations are computationally intensive and do not readily reveal the dominant contributors to the uncertainty. In this article, a closed-form approximation for the fault tree top event uncertainty distribution is developed, which is applicable when the uncertainties in the basic events of the model are lognormally distributed. The results of the approximate method are compared with results from two sampling-based methods: namely, the Monte Carlo method and the Wilks method based on order statistics. It is shown that the closed-form expression can provide a reasonable approximation to results obtained by Monte Carlo sampling, without incurring the computational expense. The Wilks method is found to be a useful means of providing an upper bound for the percentiles of the uncertainty distribution while being computationally inexpensive compared with full Monte Carlo sampling. The lognormal approximation method and Wilks's method appear attractive, practical alternatives for the evaluation of uncertainty in the output of fault trees and similar multilinear models. © 2018 Society for Risk Analysis.

  3. Symmetric Positive 4th Order Tensors & Their Estimation from Diffusion Weighted MRI⋆

    PubMed Central

    Barmpoutis, Angelos; Jian, Bing; Vemuri, Baba C.; Shepherd, Timothy M.

    2009-01-01

    In Diffusion Weighted Magnetic Resonance Image (DW-MRI) processing a 2nd order tensor has been commonly used to approximate the diffusivity function at each lattice point of the DW-MRI data. It is now well known that this 2nd-order approximation fails to approximate complex local tissue structures, such as fibers crossings. In this paper we employ a 4th order symmetric positive semi-definite (PSD) tensor approximation to represent the diffusivity function and present a novel technique to estimate these tensors from the DW-MRI data guaranteeing the PSD property. There have been several published articles in literature on higher order tensor approximations of the diffusivity function but none of them guarantee the positive semi-definite constraint, which is a fundamental constraint since negative values of the diffusivity coefficients are not meaningful. In our methods, we parameterize the 4th order tensors as a sum of squares of quadratic forms by using the so called Gram matrix method from linear algebra and its relation to the Hilbert’s theorem on ternary quartics. This parametric representation is then used in a nonlinear-least squares formulation to estimate the PSD tensors of order 4 from the data. We define a metric for the higher-order tensors and employ it for regularization across the lattice. Finally, performance of this model is depicted on synthetic data as well as real DW-MRI from an isolated rat hippocampus. PMID:17633709

  4. Exact renormalization group equations: an introductory review

    NASA Astrophysics Data System (ADS)

    Bagnuls, C.; Bervillier, C.

    2001-07-01

    We critically review the use of the exact renormalization group equations (ERGE) in the framework of the scalar theory. We lay emphasis on the existence of different versions of the ERGE and on an approximation method to solve it: the derivative expansion. The leading order of this expansion appears as an excellent textbook example to underline the nonperturbative features of the Wilson renormalization group theory. We limit ourselves to the consideration of the scalar field (this is why it is an introductory review) but the reader will find (at the end of the review) a set of references to existing studies on more complex systems.

  5. QCD corrections to massive color-octet vector boson pair production

    NASA Astrophysics Data System (ADS)

    Freitas, Ayres; Wiegand, Daniel

    2017-09-01

    This paper describes the calculation of the next-to-leading order (NLO) QCD corrections to massive color-octet vector boson pair production at hadron colliders. As a concrete framework, a two-site coloron model with an internal parity is chosen, which can be regarded as an effective low-energy approximation of Kaluza-Klein gluon physics in universal extra dimensions. The renormalization procedure involves several subtleties, which are discussed in detail. The impact of the NLO corrections is relatively modest, amounting to a reduction of 11-14% in the total cross-section, but they significantly reduce the scale dependence of the LO result.

  6. Transverse flow induced by inhomogeneous magnetic fields in the Bjorken expansion

    NASA Astrophysics Data System (ADS)

    Pu, Shi; Yang, Di-Lun

    2016-03-01

    We investigate the magnetohydrodynamics in the presence of an external magnetic field following the power-law decay in proper time and having spatial inhomogeneity characterized by a Gaussian distribution in one of transverse coordinates under the Bjorken expansion. The leading-order solution is obtained in the weak-field approximation, where both energy density and fluid velocity are modified. It is found that the spatial gradient of the magnetic field results in transverse flow, where the flow direction depends on the decay exponents of the magnetic field. We suggest that such a magnetic-field-induced effect might influence anisotropic flow in heavy ion collisions.

  7. Effective Methods for Solving Band SLEs after Parabolic Nonlinear PDEs

    NASA Astrophysics Data System (ADS)

    Veneva, Milena; Ayriyan, Alexander

    2018-04-01

    A class of models of heat transfer processes in a multilayer domain is considered. The governing equation is a nonlinear heat-transfer equation with different temperature-dependent densities and thermal coefficients in each layer. Homogeneous Neumann boundary conditions and ideal contact ones are applied. A finite difference scheme on a special uneven mesh with a second-order approximation in the case of a piecewise constant spatial step is built. This discretization leads to a pentadiagonal system of linear equations (SLEs) with a matrix which is neither diagonally dominant, nor positive definite. Two different methods for solving such a SLE are developed - diagonal dominantization and symbolic algorithms.

  8. Haze formation in model beer systems.

    PubMed

    Miedl, Michaela; Garcia, Marco A; Bamforth, Charles W

    2005-12-28

    The interaction of a haze-active protein (gliadin) and a haze-active polyphenol (tannic acid) was studied in a model beer system in order to investigate the principle mechanisms of haze formation at low temperatures. Low concentrations (g/L) of tannic acid, high concentrations of gliadin, and comparatively high temperatures lead to maximum haze values. When considered on a molar basis, the greatest haze levels are displayed at an approximate 1:1 equivalence of polyphenol and protein. The greater part of haze formation was completed within 0.5 h, irrespective of the concentration of gliadin, the concentration of tannic acid, and the temperature of the model solution.

  9. Subsonic longitudinal and lateral-directional static aerodynamic characteristics of a general research fighter model employing a strake-wing concept

    NASA Technical Reports Server (NTRS)

    Fox, C. H., Jr.

    1978-01-01

    A general research fighter model was tested in the Langley 7 by 10 foot high speed tunnel at a Mach number of 0.3. Strakes with exposed semi-spans of 10 percent, 20 percent, and 30 percent of the wing reference semi-span were tested in combination with wings having leading edge sweep angles of 30, 44, and 60 degrees. The angle of attack range was from -4 degrees to approximately 48 degrees at sideslip angles of 0, -5, and 5 degrees. The data are presented without analysis in order to expedite publication.

  10. Comprehensive description of J / ψ production in proton-proton collisions at collider energies

    DOE PAGES

    Ma, Yan -Qing; Venugopalan, Raju

    2014-11-04

    We employ a small x Color Glass Condensate + Non-Relativistic QCD (NRQCD) formalism to compute J/ψ production at low p⊥ in proton-proton collisions at collider energies. Very good agreement is obtained for total cross-sections, rapidity distributions and low momentum p⊥ distributions. Similar agreement is obtained for ψ' production. We observe an overlap region in p⊥ where our results match smoothly to those obtained in a next-to-leading order (NLO) collinearly factorized NRQCD formalism. The relative contribution of color singlet and color octet contributions can be quantified in the CGC+NRQCD framework, with the former contributing approximately 10% of the total cross-section.

  11. Algebraic perturbation theory for dense liquids with discrete potentials

    NASA Astrophysics Data System (ADS)

    Adib, Artur B.

    2007-06-01

    A simple theory for the leading-order correction g1(r) to the structure of a hard-sphere liquid with discrete (e.g., square-well) potential perturbations is proposed. The theory makes use of a general approximation that effectively eliminates four-particle correlations from g1(r) with good accuracy at high densities. For the particular case of discrete perturbations, the remaining three-particle correlations can be modeled with a simple volume-exclusion argument, resulting in an algebraic and surprisingly accurate expression for g1(r) . The structure of a discrete “core-softened” model for liquids with anomalous thermodynamic properties is reproduced as an application.

  12. [CF Lung Disease - a German S3 Guideline: Module 2: Diagnostics and Treatment in Chronic Infection with Pseudomonas aeruginosa].

    PubMed

    Schwarz, C; Schulte-Hubbert, B; Bend, J; Abele-Horn, M; Baumann, I; Bremer, W; Brunsmann, F; Dieninghoff, D; Eickmeier, O; Ellemunter, H; Fischer, R; Grosse-Onnebrink, J; Hammermann, J; Hebestreit, H; Hogardt, M; Hügel, C; Hug, M; Illing, S; Jung, A; Kahl, B; Koitschev, A; Mahlberg, R; Mainz, J G; Mattner, F; Mehl, A; Möller, A; Muche-Borowski, C; Nüßlein, T; Puderbach, M; Renner, S; Rietschel, E; Ringshausen, F C; Schmidt, S; Sedlacek, L; Sitter, H; Smaczny, C; Tümmler, B; Vonberg, R; Wielpütz, M O; Wilkens, H; Wollschläger, B; Zerlik, J; Düesberg, U; van Koningsbruggen-Rietschel, S

    2018-05-01

    Cystic Fibrosis (CF) is the most common autosomal-recessive genetic disease affecting approximately 8000 people in Germany. The disease is caused by mutations in the Cystic Fibrosis Transmembrane Conductance Regulator (CFTR) gene leading to dysfunction of CFTR, a transmembrane chloride channel. This defect causes insufficient hydration of the epithelial lining fluid which leads to chronic inflammation of the airways. Recurrent infections of the airways as well as pulmonary exacerbations aggravate chronic inflammation, lead to pulmonary fibrosis and tissue destruction up to global respiratory insufficiency, which is responsible for the mortality in over 90 % of patients. The main aim of pulmonary treatment in CF is to reduce pulmonary inflammation and chronic infection. Pseudomonas aeruginosa ( Pa ) is the most relevant pathogen in the course of CF lung disease. Colonization and chronic infection are leading to additional loss of pulmonary function. There are many possibilities to treat Pa -infection. This is a S3-clinical guideline which implements a definition for chronic Pa -infection and demonstrates evidence-based diagnostic methods and medical treatment for Pa -infection in order to give guidance for individual treatment options. © Georg Thieme Verlag KG Stuttgart · New York.

  13. Application of six sigma and AHP in analysis of variable lead time calibration process instrumentation

    NASA Astrophysics Data System (ADS)

    Rimantho, Dino; Rahman, Tomy Abdul; Cahyadi, Bambang; Tina Hernawati, S.

    2017-02-01

    Calibration of instrumentation equipment in the pharmaceutical industry is an important activity to determine the true value of a measurement. Preliminary studies indicated that occur lead-time calibration resulted in disruption of production and laboratory activities. This study aimed to analyze the causes of lead-time calibration. Several methods used in this study such as, Six Sigma in order to determine the capability process of the calibration instrumentation of equipment. Furthermore, the method of brainstorming, Pareto diagrams, and Fishbone diagrams were used to identify and analyze the problems. Then, the method of Hierarchy Analytical Process (AHP) was used to create a hierarchical structure and prioritize problems. The results showed that the value of DPMO around 40769.23 which was equivalent to the level of sigma in calibration equipment approximately 3,24σ. This indicated the need for improvements in the calibration process. Furthermore, the determination of problem-solving strategies Lead Time Calibration such as, shortens the schedule preventive maintenance, increase the number of instrument Calibrators, and train personnel. Test results on the consistency of the whole matrix of pairwise comparisons and consistency test showed the value of hierarchy the CR below 0.1.

  14. Ambient lead measurements in Cairo, Egypt

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Howes, J.E. Jr.; Labib, M.; Samaha, N.

    1999-07-01

    The Cairo Air Improvement Project (CAIP) has established a network of 36 stations to monitor airborne lead levels in the Greater Cairo Area. Data obtained during the first 4 months of the monitoring program indicates that lead levels in ambient air significantly exceed the Government of Egypt's (GOE) Law Number 4 (1994) limit of 1 {micro} g/m{sup 3} (annual mean) in areas downwind of secondary lead smelters and in heavily trafficked areas. The highest mean and single sampling event lead levels were observed in the heavily industrialized areas of Shoubra el-Kheima and Tebbin. At two sites in Shoubra el-Kheima, meanmore » and maximum lead levels were determined to be approximately 20 {micro} g/m{sup 3} and 79 {micro} g/m{sup 3}, respectively. At three sites located in areas of high motor vehicle traffic in the central part of the city, the mean lead level was about 4 {micro} g/m{sup 3} and the maximum levels ranged from approximately 10 x 20 {micro} g/m{sup 3}. Of the remainder of the sites, the mean lead concentrations were 2fd3 {micro} g/m{sup 3} at three sites, 1 P2 {mu} g/m{sup 3} at 16 sites, and below 1 {micro} g/m{sup 3} at eight sites. Lead levels in areas devoted primarily to residential use were generally less than 2 {micro} g/m{sup 3}. The maximum mean monthly PM{sub 10} lead value measured at fugitive emission monitoring sites near lead smelters was approximately 73 {micro} g/m{sup 3}. The maximum lead concentration measured during a single sampling event was 180 {micro} g/m{sup 3}. Generally lower lead levels were observed in December due to regulation action that resulted in some suspension of smelting operations and to approximately 180-degree wind direction shifts that typically occur during this period of the year. The GOE is working vigorously to eliminate the lead problem in Egypt through implementation of the Lead Exposure Action Plan (LEAP). A major component of LEAP is the Lead Smelter Action Plan (LSAP).« less

  15. Uniformly high-order accurate non-oscillatory schemes, 1

    NASA Technical Reports Server (NTRS)

    Harten, A.; Osher, S.

    1985-01-01

    The construction and the analysis of nonoscillatory shock capturing methods for the approximation of hyperbolic conservation laws was begun. These schemes share many desirable properties with total variation diminishing schemes (TVD), but TVD schemes have at most first order accuracy, in the sense of truncation error, at extreme of the solution. A uniformly second order approximation was constucted, which is nonoscillatory in the sense that the number of extrema of the discrete solution is not increasing in time. This is achieved via a nonoscillatory piecewise linear reconstruction of the solution from its cell averages, time evolution through an approximate solution of the resulting initial value problem, and averaging of this approximate solution over each cell.

  16. Effects of Pb Smelting on the Soil Bacterial Community near a Secondary Lead Plant.

    PubMed

    Luo, Zhanbin; Ma, Jing; Chen, Fu; Li, Xiaoxiao; Zhang, Shaoliang

    2018-05-20

    Secondary lead smelting is a widespread industrial activity which has exacerbated Pb or Cd contamination of soil and water across the world. Soil physicochemical properties, soil enzyme activities, heavy metal concentrations, and bacterial diversity near a secondary lead plant in Xuzhou, China were examined in this study. The results showed that secondary lead smelting activities influenced nearby soils. Soil acidification decreased one order of magnitude, with a mean value of 7.3. Soil organic matter also showed a downward trend, while potassium and nitrogen appeared to accumulate. Soil urease and protease activity increased in samples with greater heavy metal pollution, but overall the soil microbial biodiversity decreased. Soil heavy metal concentration-especially Pb and Cd-greatly exceeded the concentrations of Chinese Environmental Quality Standard for Soils (GB 15618-1995). Some environmental factors-such as pH, organic matter, enzyme activity, and the concentration of heavy metals-significantly affected bacterial diversity: compared with the control site, the Chao1 estimator decreased about 50%, while the Shannon diversity index dropped approximately 20%. Moreover, some genera have significant relationships with heavy metal concentration-such as Ramlibacter with Zn and Steroidobacter with Cd-which might act as bio-indicators for soil remediation. These results will provide a new insight in the future for reclaiming soil contaminants caused by secondary lead smelting.

  17. Leaching of lead by ammonium salts and EDTA from Salvinia minima biomass produced during aquatic phytoremediation.

    PubMed

    Núñez-López, Roberto Aurelio; Meas, Yunny; Gama, Silvia Citlalli; Borges, Raúl Ortega; Olguín, Eugenia J

    2008-06-15

    Plant biomass harvested after heavy-metal phytoremediation must be considered as a hazardous waste that should be contained or treated appropriately before disposal or reuse. As a potential method to detoxify the biomass and to convert this material to a suitable fertilizer or mulch, leaching of lead (Pb) from Salvinia minima biomass was studied by testing water, several aqueous ammonium salts, and EDTA solution as lead extractants. The research was carried out in two phases: (i) a leaching study to determine the lead-extraction efficiency of the different leachants, and (ii) a thermodynamic analysis to identify the likely reactions and stable Pb(II) species formed in the leaching systems of the most efficient leachants. Experimentally, lead concentrations measured in leached biomass and in leachates were significantly different among the various leachants. It was determined that the extraction strength of the leachants followed the order: EDTA>ammonium oxalate>water approximately ammonium nitrate>ammonium acetate, achieving Pb extraction efficiencies of 99%, 70%, 7.2%, 6.9% and 1.3%, respectively, in single-stage extractions. The thermodynamic study indicated that the dominant species produced by the leaching process should be the soluble species PbEDTA2- for EDTA system, and the insoluble Pb(COO)2S precipitate for the oxalate system.

  18. Organ distribution and food safety aspects of cadmium and lead in great scallops, Pecten maximus L., and Horse Mussels, Modiolus modiolus L., from Norwegian waters.

    PubMed

    Julshamn, Kaare; Duinker, Arne; Frantzen, Sylvia; Torkildsen, Lise; Maage, Amund

    2008-04-01

    The purpose of the study was to determine the levels and organ distribution of the potentially harmful inorganic elements cadmium and lead in great scallops and horse mussels from unpolluted Norwegian waters. The scallops far exceeded the EU-limit for cadmium in bivalves when all soft tissues were analysed. When only muscle and gonad were included, however, the level of cadmium was acceptable, because cadmium accumulated in the digestive gland with a mean of 52 mg/kg ww (wet weight). In horse mussel, lead was the most problematic element and the concentration varied from 1.4 to 6.6 mg/kg ww with a mean of 3.7 mg/kg ww, exceeding the EU limit of 1.5 mg Pb/kg. The highest concentration of lead was found in the kidney with an average of 120 mg/kg ww and with a maximum value of 240 mg/kg ww. The kidney tissue accounted for approximately 94% of the lead burden in the horse mussel. In order to consume these bivalves, only muscle and gonad of great scallops should be used for consumption and the kidney of horse mussel should be removed prior to consumption.

  19. In-medium Chiral Perturbation Theory beyond the Mean-Field Approximation

    NASA Astrophysics Data System (ADS)

    Meißner, Ulf-G.; Oller, José A.; Wirzba, Andreas

    2002-04-01

    An explicit expression for the generating functional of two-flavor low-energy QCD with external sources in the presence of nonvanishing nucleon densities was derived recently (J. A. Oller, Phys. Rev. C65 (2002) 025204). Within this approach we derive power counting rules for the calculation of in-medium pion properties. We develop the so-called standard rules for residual nucleon energies of the order of the pion mass and a modified scheme (nonstandard counting) for vanishing residual nucleon energies. We also establish the different scales for the range of applicability of this perturbative expansion, which are 6πfπ≃0.7 GeV for standard and 6π2fπ2/2mN≃0.27 GeV for nonstandard counting, respectively. We have performed a systematic analysis of n-point in-medium Green functions up to and including next-to-leading order when the standard rules apply. These include the in-medium contributions to quark condensates, pion propagators, pion masses, and couplings of the axial-vector, vector, and pseudoscalar currents to pions. In particular, we find a mass shift for negatively charged pions in heavy nuclei, ΔMπ-=(18±m 5) MeV, that agrees with recent determinations from deeply bound pionic 207Pb. We have also established the absence of in-medium renormalization in the π0→γγ decay amplitude up to the same order. The study of ππ scattering requires the use of the nonstandard counting and the calculation is done at leading order. Even at that order we establish new contributions not considered so far. We also point toward further possible improvements of this scheme and touch upon its relation to more conventional many-body approaches.

  20. Antiferromagnetic order and the structural order-disorder transition in the Cd6Ho quasicrystal approximant

    NASA Astrophysics Data System (ADS)

    Kreyssig, Andreas; Beutier, Guillaume; Hiroto, Takanobu; Kim, Min Gyu; Tucker, Gregory S.; de Boissieu, Marc; Tamura, Ryuji; Goldman, Alan I.

    2013-09-01

    It has generally been accepted that the orientational ordering of the Cd4 tetrahedron within the Cd6 R quasicrystal approximants is kinetically inhibited for R = Ho, Er, Tm and Lu by steric constraints. Our high-resolution X-ray scattering measurements of the Cd6Ho quasicrystal approximant, however, reveal an abrupt (first-order) transition to a monoclinic structure below T S = 178 K for samples that have 'aged' at room temperature for approximately one year, reopening this question. Using X-ray resonant magnetic scattering at the Ho L 3-edge we have elucidated the nature of the antiferromagnetic ordering below T N = 8.5 K in Cd6Ho. The magnetic Bragg peaks are found at the charge forbidden H + K + L = 2n + 1 positions, referenced to the high-temperature body-centred cubic structure. In general terms, this corresponds to antiferromagnetic arrangements of the Ho moments on adjacent clusters in the unit cell as previously found for Cd6Tb.

  1. Approach for Uncertainty Propagation and Robust Design in CFD Using Sensitivity Derivatives

    NASA Technical Reports Server (NTRS)

    Putko, Michele M.; Newman, Perry A.; Taylor, Arthur C., III; Green, Lawrence L.

    2001-01-01

    This paper presents an implementation of the approximate statistical moment method for uncertainty propagation and robust optimization for a quasi 1-D Euler CFD (computational fluid dynamics) code. Given uncertainties in statistically independent, random, normally distributed input variables, a first- and second-order statistical moment matching procedure is performed to approximate the uncertainty in the CFD output. Efficient calculation of both first- and second-order sensitivity derivatives is required. In order to assess the validity of the approximations, the moments are compared with statistical moments generated through Monte Carlo simulations. The uncertainties in the CFD input variables are also incorporated into a robust optimization procedure. For this optimization, statistical moments involving first-order sensitivity derivatives appear in the objective function and system constraints. Second-order sensitivity derivatives are used in a gradient-based search to successfully execute a robust optimization. The approximate methods used throughout the analyses are found to be valid when considering robustness about input parameter mean values.

  2. Cosmological collapse and the improved Zel'dovich approximation.

    NASA Astrophysics Data System (ADS)

    Salopek, D. S.; Stewart, J. M.; Croudace, K. M.; Parry, J.

    Using a general relativistic formulation, the authors show how to compute the higher order terms in the Zel'dovich approximation which describes cosmological collapse. They evolve the 3-metric in a spatial gradient expansion. Their method is an advance over earlier work because it is local at each order. Using the improved Zel'dovich approximation, they compute the epoch of collapse.

  3. Hawking radiation due to photon and gravitino tunneling

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Majhi, Bibhas Ranjan, E-mail: bibhas@bose.res.i; Samanta, Saurav, E-mail: srvsmnt@gmail.co

    2010-11-15

    Applying the Hamilton-Jacobi method we investigate the tunneling of photon across the event horizon of a static spherically symmetric black hole. The necessity of the gauge condition on the photon field, to derive the semiclassical Hawking temperature, is explicitly shown. Also, the tunneling of photon and gravitino beyond this semiclassical approximation are presented separately. Quantum corrections of the action for both cases are found to be proportional to the semiclassical contribution. Modifications to the Hawking temperature and Bekenstein-Hawking area law are thereby obtained. Using this corrected temperature and Hawking's periodicity argument, the modified metric for the Schwarzschild black hole ismore » given. This corrected version of the metric, up to h order is equivalent to the metric obtained by including one loop back reaction effect. Finally, the coefficient of the leading order correction of entropy is shown to be related to the trace anomaly.« less

  4. Effect of transition dipole phase on high-order-harmonic generation in solid materials

    NASA Astrophysics Data System (ADS)

    Jiang, Shicheng; Wei, Hui; Chen, Jigen; Yu, Chao; Lu, Ruifeng; Lin, C. D.

    2017-11-01

    High-order harmonic spectra from solid materials driven by single-color multicycle laser fields sometimes contain even harmonics. In this work we attribute the appearance of even harmonics to the nonzero transition dipole phase (TDP) when the solid system has broken symmetry. By calculating the harmonic efficiency from graphene and gapped graphene by using the semiconductor Bloch equations under the tight-binding approximation, we demonstrate the role of the TDP, which has been ignored for a long time. When the crystal has inversion symmetry, or reflection symmetry with the symmetry plane perpendicular to the laser polarization direction, the TDP can be neglected. Without such symmetry, however, the TDP will lead to the appearance of even harmonics. We further show that the TDP is sensitive to the crystal geometry. To extract the structure information from the harmonic spectra of a solid the TDP cannot be ignored.

  5. A hybridized formulation for the weak Galerkin mixed finite element method

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Mu, Lin; Wang, Junping; Ye, Xiu

    This paper presents a hybridized formulation for the weak Galerkin mixed finite element method (WG-MFEM) which was introduced and analyzed in Wang and Ye (2014) for second order elliptic equations. The WG-MFEM method was designed by using discontinuous piecewise polynomials on finite element partitions consisting of polygonal or polyhedral elements of arbitrary shape. The key to WG-MFEM is the use of a discrete weak divergence operator which is defined and computed by solving inexpensive problems locally on each element. The hybridized formulation of this paper leads to a significantly reduced system of linear equations involving only the unknowns arising frommore » the Lagrange multiplier in hybridization. Optimal-order error estimates are derived for the hybridized WG-MFEM approximations. In conclusion, some numerical results are reported to confirm the theory and a superconvergence for the Lagrange multiplier.« less

  6. A hybridized formulation for the weak Galerkin mixed finite element method

    DOE PAGES

    Mu, Lin; Wang, Junping; Ye, Xiu

    2016-01-14

    This paper presents a hybridized formulation for the weak Galerkin mixed finite element method (WG-MFEM) which was introduced and analyzed in Wang and Ye (2014) for second order elliptic equations. The WG-MFEM method was designed by using discontinuous piecewise polynomials on finite element partitions consisting of polygonal or polyhedral elements of arbitrary shape. The key to WG-MFEM is the use of a discrete weak divergence operator which is defined and computed by solving inexpensive problems locally on each element. The hybridized formulation of this paper leads to a significantly reduced system of linear equations involving only the unknowns arising frommore » the Lagrange multiplier in hybridization. Optimal-order error estimates are derived for the hybridized WG-MFEM approximations. In conclusion, some numerical results are reported to confirm the theory and a superconvergence for the Lagrange multiplier.« less

  7. Bigravity from gradient expansion

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Yamashita, Yasuho; Tanaka, Takahiro; Department of Physics, Kyoto University,606-8502, Kyoto

    2016-05-04

    We discuss how the ghost-free bigravity coupled with a single scalar field can be derived from a braneworld setup. We consider DGP two-brane model without radion stabilization. The bulk configuration is solved for given boundary metrics, and it is substituted back into the action to obtain the effective four-dimensional action. In order to obtain the ghost-free bigravity, we consider the gradient expansion in which the brane separation is supposed to be sufficiently small so that two boundary metrics are almost identical. The obtained effective theory is shown to be ghost free as expected, however, the interaction between two gravitons takesmore » the Fierz-Pauli form at the leading order of the gradient expansion, even though we do not use the approximation of linear perturbation. We also find that the radion remains as a scalar field in the four-dimensional effective theory, but its coupling to the metrics is non-trivial.« less

  8. Pattern statistics on Markov chains and sensitivity to parameter estimation

    PubMed Central

    Nuel, Grégory

    2006-01-01

    Background: In order to compute pattern statistics in computational biology a Markov model is commonly used to take into account the sequence composition. Usually its parameter must be estimated. The aim of this paper is to determine how sensitive these statistics are to parameter estimation, and what are the consequences of this variability on pattern studies (finding the most over-represented words in a genome, the most significant common words to a set of sequences,...). Results: In the particular case where pattern statistics (overlap counting only) computed through binomial approximations we use the delta-method to give an explicit expression of σ, the standard deviation of a pattern statistic. This result is validated using simulations and a simple pattern study is also considered. Conclusion: We establish that the use of high order Markov model could easily lead to major mistakes due to the high sensitivity of pattern statistics to parameter estimation. PMID:17044916

  9. Pattern statistics on Markov chains and sensitivity to parameter estimation.

    PubMed

    Nuel, Grégory

    2006-10-17

    In order to compute pattern statistics in computational biology a Markov model is commonly used to take into account the sequence composition. Usually its parameter must be estimated. The aim of this paper is to determine how sensitive these statistics are to parameter estimation, and what are the consequences of this variability on pattern studies (finding the most over-represented words in a genome, the most significant common words to a set of sequences,...). In the particular case where pattern statistics (overlap counting only) computed through binomial approximations we use the delta-method to give an explicit expression of sigma, the standard deviation of a pattern statistic. This result is validated using simulations and a simple pattern study is also considered. We establish that the use of high order Markov model could easily lead to major mistakes due to the high sensitivity of pattern statistics to parameter estimation.

  10. Auger recombination in Dirac materials: A tangle of many-body effects

    NASA Astrophysics Data System (ADS)

    Alymov, Georgy; Vyurkov, Vladimir; Ryzhii, Victor; Satou, Akira; Svintsov, Dmitry

    2018-05-01

    The peculiar electron dispersion in Dirac materials makes lowest-order Auger processes prohibited or marginally prohibited by energy and momentum conservation laws. Thus, Auger recombination (AR) in these materials is very sensitive to many-body effects. We incorporate them at the level of the G W approximation into the nonequilibrium Green's functions approach to AR and study the role of dynamic screening, spectrum broadening, and renormalization in the case of weakly pumped undoped graphene. We find that incorrect treatment of many-body effects can lead to an order-of-magnitude error in the recombination rate. We show that the AR time depends weakly (sublinearly) on the background dielectric constant, which limits the possibility to control recombination by the choice of substrate. However, the AR time can be considerably prolonged by placing graphene under a metal gate or by introducing a band gap. With carrier cooling taken into account, our results comply with experiments on photoexcited graphene.

  11. A Higher-Order Bending Theory for Laminated Composite and Sandwich Beams

    NASA Technical Reports Server (NTRS)

    Cook, Geoffrey M.

    1997-01-01

    A higher-order bending theory is derived for laminated composite and sandwich beams. This is accomplished by assuming a special form for the axial and transverse displacement expansions. An independent expansion is also assumed for the transverse normal stress. Appropriate shear correction factors based on energy considerations are used to adjust the shear stiffness. A set of transverse normal correction factors is introduced, leading to significant improvements in the transverse normal strain and stress for laminated composite and sandwich beams. A closed-form solution to the cylindrical elasticity solutions for a wide range of beam aspect ratios and commonly used material systems. Accurate shear stresses for a wide range of laminates, including the challenging unsymmetric composite and sandwich laminates, are obtained using an original corrected integration scheme. For application of the theory to a wider range of problems, guidelines for finite element approximations are presented.

  12. Role of fluctuations in random compressible systems at marginal dimensionality

    NASA Astrophysics Data System (ADS)

    Meissner, G.; Sasvári, L.; Tadić, B.

    1986-07-01

    In a unified treatment we have studied the role of fluctuations in uniaxial random systems at marginal dimensionality d*=4 with the n=1 component order parameter being coupled to elastic degrees of freedom. Depending on the ratio of the nonuniversal parameters of quenched disorder Δ0 and of elastic fluctuations v~0, a first- or second-order phase transition is found to occur, separated by a tricritical point. A complete account of critical properties and of macroscopic as well as of microscopic elastic stability is given for temperatures T>Tc. Universal singularities of thermodynamic functions are determined for t=(T-Tc)/Tc-->0 including the tricritical point: for v~0/Δ0>-2, they are the same as in a rigid random system; for v~0/Δ0=-2, they are different due to lattice compressibility being related, however, to the former by Fisher renormalization. Fluctuation corrections in one-loop approximation have been evaluated in a nonuniversal critical temperature range, tx<

  13. NEW DEVELOPMENTS ON INVERSE POLYGON MAPPING TO CALCULATE GRAVITATIONAL LENSING MAGNIFICATION MAPS: OPTIMIZED COMPUTATIONS

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Mediavilla, E.; Lopez, P.; Mediavilla, T.

    2011-11-01

    We derive an exact solution (in the form of a series expansion) to compute gravitational lensing magnification maps. It is based on the backward gravitational lens mapping of a partition of the image plane in polygonal cells (inverse polygon mapping, IPM), not including critical points (except perhaps at the cell boundaries). The zeroth-order term of the series expansion leads to the method described by Mediavilla et al. The first-order term is used to study the error induced by the truncation of the series at zeroth order, explaining the high accuracy of the IPM even at this low order of approximation.more » Interpreting the Inverse Ray Shooting (IRS) method in terms of IPM, we explain the previously reported N {sup -3/4} dependence of the IRS error with the number of collected rays per pixel. Cells intersected by critical curves (critical cells) transform to non-simply connected regions with topological pathologies like auto-overlapping or non-preservation of the boundary under the transformation. To define a non-critical partition, we use a linear approximation of the critical curve to divide each critical cell into two non-critical subcells. The optimal choice of the cell size depends basically on the curvature of the critical curves. For typical applications in which the pixel of the magnification map is a small fraction of the Einstein radius, a one-to-one relationship between the cell and pixel sizes in the absence of lensing guarantees both the consistence of the method and a very high accuracy. This prescription is simple but very conservative. We show that substantially larger cells can be used to obtain magnification maps with huge savings in computation time.« less

  14. Basement-involved faults and deep structures in the West Philippine Basin: constrains from gravity field

    NASA Astrophysics Data System (ADS)

    Wang, Gang; Jiang, Suhua; Li, Sanzhong; Zhang, Huixuan; Lei, Jianping; Gao, Song; Zhao, Feiyu

    2017-06-01

    To reveal the basement-involved faults and deep structures of the West Philippine Basin (WPB), the gravitational responses caused by these faults are observed and analyzed based on the latest spherical gravity model: WGM2012 Model. By mapping the free-air and Bouguer gravity anomalies, several main faults and some other linear structures are located and observed in the WPB. Then, by conducting a 2D discrete multi-scale wavelet decomposition, the Bouguer anomalies are decomposed into the first- to eighth-order detail and approximation fields (the first- to eighth-order Details and Approximations). The first- to third-order Details reflect detailed and localized geological information of the crust at different depths, and of which the higher-order reflects gravity field of the deeper depth. The first- to fourth-order Approximations represent the regional gravity fields at different depths of the crust, respectively. The fourth-order Approximation represents the regional gravity fluctuation caused by the density inhomogeneity of Moho interface. Therefore, taking the fourth-order Approximation as input, and adopting Parker-Oldenburg interactive inversion, We calculated the depth of Moho interface in the WPB. Results show that the Moho interface depth in the WPB ranges approximately from 8 to 12 km, indicating that there is typical oceanic crust in the basin. In the Urdaneta Plateau and the Benham Rise, the Moho interface depths are about 14 and 16 km, respectively, which provides a piece of evidence to support that the Banham Rise could be a transitional crust caused by a large igneous province. The second-order vertical derivative and the horizontal derivatives in direction 0° and 90° are computed based on the data of the third-order Detail, and most of the basement-involved faults and structures in the WPB, such as the Central Basin Fault Zone, the Gagua Ridge, the Luzon-Okinawa Fault Zone, and the Mindanao Fault Zone are interpreted by the gravity derivatives.

  15. Magnetic Fields and Multiple Protostar Formation

    NASA Astrophysics Data System (ADS)

    Boss, A. P.

    2001-12-01

    Recent observations of star-forming regions suggest that binary and multiple young stars are the rule rather than the exception, and implicate fragmentation as the likely mechanism for their formation. Most numerical hydrodynamical calculations of fragmentation have neglected the possibly deleterious effects of magnetic fields, in spite of ample evidence for the importance of magnetic support of pre-collapse clouds. We present here the first numerical hydrodynamical survey of the full effects of magnetic fields on the collapse and fragmentation of dense cloud cores. The models are calculated with a three dimensional, finite differences code which solves the equations of hydrodynamics, gravitation, and radiative transfer in the Eddington and diffusion approximations. Magnetic field effects are included through two simple approximations: magnetic pressure is added to the gas pressure, and magnetic tension is approximated by gravity dilution once collapse is well underway. Ambipolar diffusion of the magnetic field leading to cloud collapse is treated approximately as well. Models are calculated for a variety of initial cloud density profiles, shapes, and rotation rates. We find that in spite of the inclusion of magnetic field effects, dense cloud cores are capable of fragmenting into binary and multiple protostar systems. Initially prolate clouds tend to fragment into binary protostars, while initially oblate clouds tend to fragment into multiple protostar systems containing a small number (of order four) of fragments. The latter are likely to be subject to rapid orbital evolution, with close encounters possibly leading to the ejection of fragments. Contrary to expectation, magnetic tension effects appear to enhance fragmentation, allowing lower mass fragments to form than would otherwise be possible, because magnetic tension helps to prevent a central density singularity from forming and producing a dominant single object. Magnetically-supported dense cloud cores thus seem to be capable of collapsing and fragmenting into sufficient numbers of binary and multiple protostar systems to be compatible with observations of the relative rarity of single protostars. This work was partially supported by NSF grants AST-9983530 and MRI-9976645.

  16. Some preliminary calculations of whole atom Compton scattering of unpolarized photons

    NASA Astrophysics Data System (ADS)

    Bergstrom, P. M.; Surić, T.; Pisk, K.; Pratt, R. H.

    1992-07-01

    This paper represents a preliminary attempt to develop a practical prescription for calculating whole atom cross sections for the Compton scattering of unpolarized photons from the bound electrons of an atom for the entire spectrum of scattered photon energies. We initially study the scattering of 2.94 keV photons from carbon. We make use of our new second order S-matrix computer code in this case to verify that, when our recently developed criterion for the validity of the relativistic impulse approximation (which concerns the average momentum contributing to the photon spectrum ( pav)) is satisfied, the spectrum is adequately described by the impulse approximation. This criterion is generally satisfied in the peak intensity region for scattering by the outer shells, which dominate at these scattered photon energies. For soft scattered photons, however, the spectrum, dominated by K shell contributions, is given by terms corresponding to the contribution of the " p· A" term in the nonrelativistic interaction Hamiltonian, not included in the impulse approximation. Here, the spectrum is adequately reproduced by the K shell contribution. We then consider scattering of 17.4 keV photons from aluminum and 279.1 keV photons from lead. In these cases we use the S-matrix for the K shell and the impulse approximation for the outer shells, and find good agreement with experiment.

  17. Precise calibration of spatial phase response nonuniformity arising in liquid crystal on silicon.

    PubMed

    Xu, Jingquan; Qin, SiYi; Liu, Chen; Fu, Songnian; Liu, Deming

    2018-06-15

    In order to calibrate the spatial phase response nonuniformity of liquid crystal on silicon (LCoS), we propose to use a Twyman-Green interferometer to characterize the wavefront distortion, due to the inherent curvature of the device. During the characterization, both the residual carrier frequency introduced by the Fourier transform evaluation method and the lens aberration are error sources. For the tilted phase error introduced by residual carrier frequency, the least mean square fitting method is used to obtain the tilted phase error. Meanwhile, we use Zernike polynomials fitting based on plane mirror calibration to mitigate the lens aberration. For a typical LCoS with 1×12,288 pixels after calibration, the peak-to-valley value of the inherent wavefront distortion is approximately 0.25λ at 1550 nm, leading to a half-suppression of wavefront distortion. All efforts can suppress the root mean squares value of the inherent wavefront distortion to approximately λ/34.

  18. Asymptotically free theory with scale invariant thermodynamics

    NASA Astrophysics Data System (ADS)

    Ferrari, Gabriel N.; Kneur, Jean-Loïc; Pinto, Marcus Benghi; Ramos, Rudnei O.

    2017-12-01

    A recently developed variational resummation technique, incorporating renormalization group properties consistently, has been shown to solve the scale dependence problem that plagues the evaluation of thermodynamical quantities, e.g., within the framework of approximations such as in the hard-thermal-loop resummed perturbation theory. This method is used in the present work to evaluate thermodynamical quantities within the two-dimensional nonlinear sigma model, which, apart from providing a technically simpler testing ground, shares some common features with Yang-Mills theories, like asymptotic freedom, trace anomaly and the nonperturbative generation of a mass gap. The present application confirms that nonperturbative results can be readily generated solely by considering the lowest-order (quasiparticle) contribution to the thermodynamic effective potential, when this quantity is required to be renormalization group invariant. We also show that when the next-to-leading correction from the method is accounted for, the results indicate convergence, apart from optimally preserving, within the approximations here considered, the sought-after scale invariance.

  19. Anisotropic hydrodynamics for conformal Gubser flow

    NASA Astrophysics Data System (ADS)

    Nopoush, Mohammad; Ryblewski, Radoslaw; Strickland, Michael

    2015-02-01

    We derive the equations of motion for a system undergoing boost-invariant longitudinal and azimuthally symmetric transverse "Gubser flow" using leading-order anisotropic hydrodynamics. This is accomplished by assuming that the one-particle distribution function is ellipsoidally symmetric in the momenta conjugate to the de Sitter coordinates used to parametrize the Gubser flow. We then demonstrate that the S O (3 )q symmetry in de Sitter space further constrains the anisotropy tensor to be of spheroidal form. The resulting system of two coupled ordinary differential equations for the de Sitter-space momentum scale and anisotropy parameter are solved numerically and compared to a recently obtained exact solution of the relaxation-time-approximation Boltzmann equation subject to the same flow. We show that anisotropic hydrodynamics describes the spatiotemporal evolution of the system better than all currently known dissipative hydrodynamics approaches. In addition, we prove that anisotropic hydrodynamics gives the exact solution of the relaxation-time approximation Boltzmann equation in the ideal, η /s →0 , and free-streaming, η /s →∞, limits.

  20. Formation of N-nitrosodimethylamine (NDMA) from dimethylamine during chlorination.

    PubMed

    Mitch, William A; Sedlak, David L

    2002-02-15

    Chlorine disinfection of secondary wastewater effluent and drinking water can result in the production of the potent carcinogen N-nitrosodimethylamine (NDMA) at concentrations of approximately 100 and 10 parts per trillion (ng/L), respectively. Laboratory experiments with potential NDMA precursors indicate that NDMA formation can form during the chlorination of dimethylamine and other secondary amines. The formation of NDMA during chlorination may involve the slow formation of 1,1-dimethylhydrazine by the reaction of monochloramine and dimethylamine followed by its rapid oxidation to NDMA and other products including dimethylcyanamide and dimethylformamide. Other pathways also lead to NDMA formation during chlorination such as the reaction of sodium hypochlorite with dimethylamine. However, the rate of NDMA formation is approximately an order of magnitude slower than that observed when monochloramine reacts with dimethylamine. The reaction exhibits a strong pH dependence due to competing reactions. It may be possible to reduce NDMA formation during chlorination by removing ammonia prior to chlorination, by breakpoint chlorination, or by avoidance of the use of monochloramine for drinking water disinfection.

  1. Görtler instability of the axisymmetric boundary layer along a cone

    NASA Astrophysics Data System (ADS)

    ITOH, Nobutake

    2014-10-01

    Exact partial differential equations are derived to describe Görtler instability, caused by a weakly concave wall, of axisymmetric boundary layers with similar velocity profiles that are decomposed into a sequence of ordinary differential systems on the assumption that the solution can be expanded into inverse powers of local Reynolds number. The leading terms of the series solution are determined by solving a non-parallel version of Görtler’s eigenvalue problem and lead to a neutral stability curve and finite values of critical Görtler number and wave number for stationary and longitudinal vortices. Higher-order terms of the series solution indicate Reynolds-number dependence of Görtler instability and a limited validity of Görtler’s approximation based on the leading terms only. The present formulation is simply applicable to two-dimensional boundary layers of similar profiles, and critical Görtler number and wave number of the Blasius boundary layer on a flat plate are given by G2c = 1.23 and β2c = 0.288, respectively, if the momentum thickness is chosen as the reference length.

  2. A modified Holly-Preissmann scheme for simulating sharp concentration fronts in streams with steep velocity gradients using RIV1Q

    NASA Astrophysics Data System (ADS)

    Liu, Zhao-wei; Zhu, De-jun; Chen, Yong-can; Wang, Zhi-gang

    2014-12-01

    RIV1Q is the stand-alone water quality program of CE-QUAL-RIV1, a hydraulic and water quality model developed by U.S. Army Corps of Engineers Waterways Experiment Station. It utilizes an operator-splitting algorithm and the advection term in governing equation is treated using the explicit two-point, fourth-order accurate, Holly-Preissmann scheme, in order to preserve numerical accuracy for advection of sharp gradients in concentration. In the scheme, the spatial derivative of the transport equation, where the derivative of velocity is included, is introduced to update the first derivative of dependent variable. In the stream with larger cross-sectional variation, steep velocity gradient can be easily found and should be estimated correctly. In the original version of RIV1Q, however, the derivative of velocity is approximated by a finite difference which is first-order accurate. Its leading truncation error leads to the numerical error of concentration which is related with the velocity and concentration gradients and increases with the decreasing Courant number. The simulation may also be unstable when a sharp velocity drop occurs. In the present paper, the derivative of velocity is estimated with a modified second-order accurate scheme and the corresponding numerical error of concentration decreases. Additionally, the stability of the simulation is improved. The modified scheme is verified with a hypothetical channel case and the results demonstrate that satisfactory accuracy and stability can be achieved even when the Courant number is very low. Finally, the applicability of the modified scheme is discussed.

  3. Atmospheric Turbulence Modeling for Aerospace Vehicles: Fractional Order Fit

    NASA Technical Reports Server (NTRS)

    Kopasakis, George (Inventor)

    2015-01-01

    An improved model for simulating atmospheric disturbances is disclosed. A scale Kolmogorov spectral may be scaled to convert the Kolmogorov spectral into a finite energy von Karman spectral and a fractional order pole-zero transfer function (TF) may be derived from the von Karman spectral. Fractional order atmospheric turbulence may be approximated with an integer order pole-zero TF fit, and the approximation may be stored in memory.

  4. Discovery of Unforeseen Lead Level Optimization Issues for High pH and Low DIC Conditions

    EPA Science Inventory

    A large northeast water utility serving over 500,000 retail and wholesale customers had historically been slightly below the 90th percentile Action Level for lead. The system had been operating at a pH of approximately 10.3, a DIC concentration of approximately 5 mg/L as C, and ...

  5. Simultaneous determination of thorium, niobium, lead, and zinc by photon-induced x-ray fluorescence of lateritic material

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    LaBrecque, J.J.; Adames, D.; Parker, W.C.

    1981-01-01

    A rapid method is presented for the simultaneous determinations of thorium, niobium, lead, and zinc in lateritic material from Cerro Impacto, Estado Bolivar, Venezuela. This technique uses a PDP - 11/05 processor - based photon induced x-ray fluorescence system. The total variations of approximately 5% for concentrations of approximately 1 and 10% for concentrations of approximately 0.1% were obtained with only 500 s of fluorescent time. The values obtained by this method were in agreement with values measured by conventional flame atomic absorption spectroscopy for lead and zinc. The values for thorium measured were in agreement with the reported valuesmore » for the reference materials supplied by NBL.« less

  6. Higher-order harmonics of general limited diffraction Bessel beams

    NASA Astrophysics Data System (ADS)

    Ding, De-Sheng; Huang, Jin-Huang

    2016-12-01

    In this paper, we extensively study the higher-order harmonic generation of the general limited diffraction m-th-order Bessel beam. The analysis is based on successive approximations of the Khokhlov-Zabolotskaya-Kuznetsov (KZK) equation. Asymptotic expansions are presented for higher-order harmonic Bessel beams in near and far fields. The validity of asymptotic approximation is also analyzed. The higher-order harmonic of the Bessel beam with the lowest zero-order is taken as a special example. Project supported by the National Natural Science Foundation of China (Grant Nos. 11074038 and 11374051).

  7. Interpretation of electron diffraction patterns from amorphous and fullerene-like carbon allotropes.

    PubMed

    Czigány, Zsolt; Hultman, Lars

    2010-06-01

    The short range order in amorphous and fullerene-like carbon compounds has been characterized by selected area electron diffraction (SAED) patterns and compared with simulations of model nanoclusters. Broad rings in SAED pattern from fullerene-like CN(x) at approximately 1.2, approximately 2, and approximately 3.5A indicate short-range order similar to that in graphite, but peak shifts indicate sheet curvature in agreement with high-resolution transmission electron microscopy images. Fullerene-like CP(x) exhibits rings at approximately 1.6 and 2.6A, which can be explained if it consists of fragments with short-range order and high curvature similar to that of C(20). Copyright 2010 Elsevier B.V. All rights reserved.

  8. Langley Full-scale-tunnel Investigation of Maximum Lift and Stability Characteristics of an Airplane Having Approximately Triangular Plan Form (DM-1 Glider)

    NASA Technical Reports Server (NTRS)

    Lovell, J Calvin; Wilson, Herbert A JR

    1947-01-01

    An investigation of the DM-1 Glider, which had approximately triangular plan form, an aspect ratio of 1.8 and a 60 degree sweptback leading edge, has been conducted in the Langley full-scale tunnel. The investigation consisted of the determination of the separate effects of the following modifications made to the glider on its maximum lift and stability characteristics: (a) installation of sharp leading edges over the inboard semispan of the wing, (b) removal of the vertical fin, (c) sealing of the elevon control-balance slots, (d) installation of redesigned thin vertical surfaces, (e) installation of faired sharp leading edges, and (f) installation of canopy. The maximum lift coefficient of the DM-1 glider was increased from 0.61 to 1.01 by the installation of semispan sharp leading edges, and from 1.01 to 1.24 by the removal of the vertical fin and sealing of the elevon control-balance slots. The highest maximum lift coefficient (1.32) was obtained when the faired sharp leading edges and the thin vertical surfaces were attached to the glider. The original DM-1 glider was longitudinally stable. The semispan sharp leading edges shifted the neutral point forward approximately 3 percent of the root chord at moderate lift coefficients, and the glider configuration with these sharp leading edges attached was longitudinally unstable, for the assumed center-of-gravity location, at lift coefficients above 0.73. Sealing the elevon control-balance slots and installing the faired sharp leading edges, the thin vertical surfaces, and the canopy shifted the neutral point forward approximately 8 percent of the root chord.

  9. The equilibrium-diffusion limit for radiation hydrodynamics

    DOE PAGES

    Ferguson, J. M.; Morel, J. E.; Lowrie, R.

    2017-07-27

    The equilibrium-diffusion approximation (EDA) is used to describe certain radiation-hydrodynamic (RH) environments. When this is done the RH equations reduce to a simplified set of equations. The EDA can be derived by asymptotically analyzing the full set of RH equations in the equilibrium-diffusion limit. Here, we derive the EDA this way and show that it and the associated set of simplified equations are both first-order accurate with transport corrections occurring at second order. Having established the EDA’s first-order accuracy we then analyze the grey nonequilibrium-diffusion approximation and the grey Eddington approximation and show that they both preserve this first-order accuracy.more » Further, these approximations preserve the EDA’s first-order accuracy when made in either the comoving-frame (CMF) or the lab-frame (LF). And while analyzing the Eddington approximation, we found that the CMF and LF radiation-source equations are equivalent when neglecting O(β 2) terms and compared in the LF. Of course, the radiation pressures are not equivalent. It is expected that simplified physical models and numerical discretizations of the RH equations that do not preserve this first-order accuracy will not retain the correct equilibrium-diffusion solutions. As a practical example, we show that nonequilibrium-diffusion radiative-shock solutions devolve to equilibrium-diffusion solutions when the asymptotic parameter is small.« less

  10. The El Paso smelter 20 years later: residual impact on Mexican children.

    PubMed

    Díaz-Barriga, F; Batres, L; Calderón, J; Lugo, A; Galvao, L; Lara, I; Rizo, P; Arroyave, M E; McConnell, R

    1997-01-01

    Although there has been considerable concern regarding cross-border industrial contamination between Mexico and the United States, there are remarkably few data. One notable case study is the smelter in El Paso, Texas. In 1974 blood lead levels higher than 40 micrograms/dl were detected in 52% of children studied near the smelter, in the adjacent Mexican community of Anapra in Ciudad Juarez, Chihuahua. Lead smelting at this plant was halted in 1985, and as a result, lead levels in air decreased sharply; consequently, children's exposure to lead and other metals should have diminished accordingly. In order to assess the effect of removal of lead emissions from the area, three geographical locations in Anapra, varying in distance from the smelter source, were evaluated for lead, arsenic, and cadmium levels in soil and for lead in blood of children. It was found that lead levels in soil were inversely correlated with distance from the smelter. Arsenic and cadmium levels in soil were constant among the three sectors. However, at residential sites closer to the smelter, a higher percentage of children was found with blood lead levels exceeding the Centers for Disease Control's action level of 10.0 micrograms/dl. In the sector closest to the border 43% of children had blood lead levels greater than 10.0 micrograms/dl. Although blood lead levels in children living in Anapra have dropped approximately fourfold in 20 years, our results indicate a moderate continued risk of lead exposure. This study demonstrates the persistent impact that may result from cross-border contamination and raises provocative questions regarding appropriate action and the responsibility for financing such action.

  11. Fourth-order numerical solutions of diffusion equation by using SOR method with Crank-Nicolson approach

    NASA Astrophysics Data System (ADS)

    Muhiddin, F. A.; Sulaiman, J.

    2017-09-01

    The aim of this paper is to investigate the effectiveness of the Successive Over-Relaxation (SOR) iterative method by using the fourth-order Crank-Nicolson (CN) discretization scheme to derive a five-point Crank-Nicolson approximation equation in order to solve diffusion equation. From this approximation equation, clearly, it can be shown that corresponding system of five-point approximation equations can be generated and then solved iteratively. In order to access the performance results of the proposed iterative method with the fourth-order CN scheme, another point iterative method which is Gauss-Seidel (GS), also presented as a reference method. Finally the numerical results obtained from the use of the fourth-order CN discretization scheme, it can be pointed out that the SOR iterative method is superior in terms of number of iterations, execution time, and maximum absolute error.

  12. Compton scattering of self-absorbed synchrotron emission

    NASA Astrophysics Data System (ADS)

    Gao, He; Lei, Wei-Hua; Wu, Xue-Feng; Zhang, Bing

    2013-11-01

    Synchrotron self-Compton (SSC) scattering is an important emission mechanism in many astronomical sources, such as gamma-ray bursts (GRBs) and active galactic nuclei. We give a complete presentation of the analytical approximations for the Compton scattering of synchrotron emission with both weak and strong synchrotron self-absorption. All possible orders of the characteristic synchrotron spectral breaks (νa, νm and νc) are studied. In the weak self-absorption regime, i.e. νa < νc, the electron energy distribution is not modified by the self-absorption process. The shape of the SSC component broadly resembles that of synchrotron, but with the following features: The SSC flux increases linearly with frequency up to the SSC break frequency corresponding to the self-absorption frequency νa; and the presence of a logarithmic term in the high-frequency range of the SSC spectra makes it harder than the power-law approximation. In the strong absorption regime, i.e. νa > νc, heating of low-energy electrons due to synchrotron absorption leads to pile-up of electrons, and form a thermal component besides the broken power-law component. This leads to two-component (thermal + non-thermal) spectra for both the synchrotron and SSC spectral components. For νc < νa < νm, the spectrum is thermal (non-thermal) dominated if ν _a > √{ν _m ν _c} (ν _a < √{ν _m ν _c}). Similar to the weak-absorption regime, the SSC spectral component is broader than the simple broken power-law approximation. We derive the critical condition for strong absorption (electron pile-up), and discuss a case of GRB reverse shock emission in a wind medium, which invokes νa > max(νm, νc).

  13. Sensitivity of tidal characteristics in double inlet systems to momentum dissipation on tidal flats: a perturbation analysis

    NASA Astrophysics Data System (ADS)

    Hepkema, Tjebbe M.; de Swart, Huib E.; Zagaris, Antonios; Duran–Matute, Matias

    2018-05-01

    In a tidal channel with adjacent tidal flats, along-channel momentum is dissipated on the flats during rising tides. This leads to a sink of along-channel momentum. Using a perturbative method, it is shown that the momentum sink slightly reduces the M2 amplitude of both the sea surface elevation and current velocity and favours flood dominant tides. These changes in tidal characteristics (phase and amplitude of sea surface elevations and currents) are noticeable if widths of tidal flats are at least of the same order as the channel width, and amplitudes and gradients of along-channel velocity are large. The M2 amplitudes are reduced because stagnant water flows from the flats into the channel, thereby slowing down the current. The M4 amplitudes and phases change because the momentum sink acts as an advective term during the fall of the tide, such a term generates flood dominant currents. For a prototype embayment that resembles the Marsdiep-Vlie double-inlet system of the Western Wadden Sea, it is found that for both the sea surface elevation and current velocity, including the momentum sink, lead to a decrease of approximately 2 % in M2 amplitudes and an increase of approximately 25 % in M4 amplitudes. As a result, the net import of coarse sediment is increased by approximately 35 %, while the transport of fine sediment is hardly influenced by the momentum sink. For the Marsdiep-Vlie system, the M2 sea surface amplitude obtained from the idealised model is similar to that computed with a realistic three-dimensional numerical model whilst the comparison with regard to M4 improves if momentum sink is accounted for.

  14. Strong anharmonicity in the phonon spectra of PbTe and SnTe from first principles

    NASA Astrophysics Data System (ADS)

    Ribeiro, Guilherme A. S.; Paulatto, Lorenzo; Bianco, Raffaello; Errea, Ion; Mauri, Francesco; Calandra, Matteo

    2018-01-01

    At room temperature, PbTe and SnTe are efficient thermoelectrics with a cubic structure. At low temperature, SnTe undergoes a ferroelectric transition with a critical temperature strongly dependent on the hole concentration, while PbTe is an incipient ferroelectric. By using the stochastic self-consistent harmonic approximation, we investigate the anharmonic phonon spectra and the occurrence of a ferroelectric transition in both systems. We find that vibrational spectra strongly depend on the approximation used for the exchange-correlation kernel in density-functional theory. If gradient corrections and the theoretical volume are employed, then the calculation of the phonon frequencies as obtained from the diagonalization of the free-energy Hessian leads to phonon spectra in good agreement with experimental data for both systems. In PbTe we evaluate the linear thermal expansion coefficient γ =2.3 ×10-5K-1 , finding it to be in good agreement with experimental value of γ =2.04 ×10-5K-1 . Furthermore, we study the phonon spectrum and we do reproduce the transverse optical mode phonon satellite detected in inelastic neutron scattering and the crossing between the transverse optical and the longitudinal acoustic modes along the Γ X direction. The phonon satellite becomes broader at high temperatures but its energy is essentially temperature independent, in agreement with experiments. We decompose the self-consistent harmonic free energy in second-, third-, and fourth-order anharmonic terms. We find that the third- and fourth-order terms are small. However, treating the third-order term perturbatively on top of the second-order self-consistent harmonic free energy overestimates the energy of the satellite associated with the transverse optical mode. On the contrary, a perturbative treatment on top of the harmonic Hamiltonian breaks down and leads to imaginary phonon frequencies already at 300 K. In the case of SnTe, we describe the occurrence of a ferroelectric transition from the high-temperature F m 3 ¯m structure to the low-temperature R 3 m one. The transition temperature is, however, underestimated with respect to the experimental one. No satellites are present in the SnTe phonon spectra despite a not negligible anharmonic broadening of the zone-center TO mode.

  15. Integrating flood modelling in a hydrological catchment model: flow approximations and spatial resolution.

    NASA Astrophysics Data System (ADS)

    van den Bout, Bastian; Jetten, Victor

    2017-04-01

    Within hydrological models, flow approximations are commonly used to reduce computation time. The validity of these approximations is strongly determined by flow height, flow velocity, the spatial resolution of the model, and by the manner in which flow routing is implemented. The assumptions of these approximations can furthermore limit emergent behavior, and influence flow behavior under space-time scaling. In this presentation, the validity and performance of the kinematic, diffusive and dynamic flow approximations are investigated for use in a catchment-based flood model. Particularly, the validity during flood events and for varying spatial resolutions is investigated. The OpenLISEM hydrological model is extended to implement these flow approximations and channel flooding based on dynamic flow. The kinematic routing uses a predefined converging flow network, the diffusive and dynamic routing uses a 2D flow solution over a DEM. The channel flow in all cases is a 1D kinematic wave approximation. The flow approximations are used to recreate measured discharge in three catchments of different size in China, Spain and Italy, among which is the hydrograph of the 2003 flood event in the Fella river basin (Italy). Furthermore, spatial resolutions are varied for the flood simulation in order to investigate the influence of spatial resolution on these flow approximations. Results show that the kinematic, diffusive and dynamic flow approximation provide least to highest accuracy, respectively, in recreating measured temporal variation of the discharge. Kinematic flow, which is commonly used in hydrological modelling, substantially over-estimates hydrological connectivity in the simulations with a spatial resolution of below 30 meters. Since spatial resolutions of models have strongly increased over the past decades, usage of routed kinematic flow should be reconsidered. In the case of flood events, spatial modelling of kinematic flow substantially over-estimates hydrological connectivity and flow concentration, leading to significant errors. The combination of diffusive or dynamic overland flow and dynamic channel flooding provides high accuracy in recreating the 2003 Fella river flood event. Finally, flow approximations substantially influenced the predictive potential of the (flash) flood model.

  16. An improved algorithm for the determination of the system paramters of a visual binary by least squares

    NASA Astrophysics Data System (ADS)

    Xu, Yu-Lin

    The problem of computing the orbit of a visual binary from a set of observed positions is reconsidered. It is a least squares adjustment problem, if the observational errors follow a bias-free multivariate Gaussian distribution and the covariance matrix of the observations is assumed to be known. The condition equations are constructed to satisfy both the conic section equation and the area theorem, which are nonlinear in both the observations and the adjustment parameters. The traditional least squares algorithm, which employs condition equations that are solved with respect to the uncorrelated observations and either linear in the adjustment parameters or linearized by developing them in Taylor series by first-order approximation, is inadequate in our orbit problem. D.C. Brown proposed an algorithm solving a more general least squares adjustment problem in which the scalar residual function, however, is still constructed by first-order approximation. Not long ago, a completely general solution was published by W.H Jefferys, who proposed a rigorous adjustment algorithm for models in which the observations appear nonlinearly in the condition equations and may be correlated, and in which construction of the normal equations and the residual function involves no approximation. This method was successfully applied in our problem. The normal equations were first solved by Newton's scheme. Practical examples show that this converges fast if the observational errors are sufficiently small and the initial approximate solution is sufficiently accurate, and that it fails otherwise. Newton's method was modified to yield a definitive solution in the case the normal approach fails, by combination with the method of steepest descent and other sophisticated algorithms. Practical examples show that the modified Newton scheme can always lead to a final solution. The weighting of observations, the orthogonal parameters and the efficiency of a set of adjustment parameters are also considered. The definition of efficiency is revised.

  17. Higher and lowest order mixed finite element approximation of subsurface flow problems with solutions of low regularity

    NASA Astrophysics Data System (ADS)

    Bause, Markus

    2008-02-01

    In this work we study mixed finite element approximations of Richards' equation for simulating variably saturated subsurface flow and simultaneous reactive solute transport. Whereas higher order schemes have proved their ability to approximate reliably reactive solute transport (cf., e.g. [Bause M, Knabner P. Numerical simulation of contaminant biodegradation by higher order methods and adaptive time stepping. Comput Visual Sci 7;2004:61-78]), the Raviart- Thomas mixed finite element method ( RT0) with a first order accurate flux approximation is popular for computing the underlying water flow field (cf. [Bause M, Knabner P. Computation of variably saturated subsurface flow by adaptive mixed hybrid finite element methods. Adv Water Resour 27;2004:565-581, Farthing MW, Kees CE, Miller CT. Mixed finite element methods and higher order temporal approximations for variably saturated groundwater flow. Adv Water Resour 26;2003:373-394, Starke G. Least-squares mixed finite element solution of variably saturated subsurface flow problems. SIAM J Sci Comput 21;2000:1869-1885, Younes A, Mosé R, Ackerer P, Chavent G. A new formulation of the mixed finite element method for solving elliptic and parabolic PDE with triangular elements. J Comp Phys 149;1999:148-167, Woodward CS, Dawson CN. Analysis of expanded mixed finite element methods for a nonlinear parabolic equation modeling flow into variably saturated porous media. SIAM J Numer Anal 37;2000:701-724]). This combination might be non-optimal. Higher order techniques could increase the accuracy of the flow field calculation and thereby improve the prediction of the solute transport. Here, we analyse the application of the Brezzi- Douglas- Marini element ( BDM1) with a second order accurate flux approximation to elliptic, parabolic and degenerate problems whose solutions lack the regularity that is assumed in optimal order error analyses. For the flow field calculation a superiority of the BDM1 approach to the RT0 one is observed, which however is less significant for the accompanying solute transport.

  18. Efficient High-Order Accurate Methods using Unstructured Grids for Hydrodynamics and Acoustics

    DTIC Science & Technology

    2007-08-31

    Leer. On upstream differencing and godunov-type schemes for hyperbolic conservation laws. SIAM Review, 25(1):35-61, 1983. [46] F . Eleuterio Toro ...early stage [4-61. The basic idea can be surmised from simple approximation theory. If a continuous function f is to be approximated over a set of...a2f 4h4 a4ff(x+eh) = f (x)+-- + _ •-+• e +0 +... (1) where 0 < e < 1 for approximations inside the interval of width h. For a second-order approximation

  19. On singlet s-wave electron-hydrogen scattering.

    NASA Technical Reports Server (NTRS)

    Madan, R. N.

    1973-01-01

    Discussion of various zeroth-order approximations to s-wave scattering of electrons by hydrogen atoms below the first excitation threshold. The formalism previously developed by the author (1967, 1968) is applied to Feshbach operators to derive integro-differential equations, with the optical-potential set equal to zero, for the singlet and triplet cases. Phase shifts of s-wave scattering are computed in the zeroth-order approximation of the Feshbach operator method and in the static-exchange approximation. It is found that the convergence of numerical computations is faster in the former approximation than in the latter.

  20. Second order accurate finite difference approximations for the transonic small disturbance equation and the full potential equation

    NASA Technical Reports Server (NTRS)

    Mostrel, M. M.

    1988-01-01

    New shock-capturing finite difference approximations for solving two scalar conservation law nonlinear partial differential equations describing inviscid, isentropic, compressible flows of aerodynamics at transonic speeds are presented. A global linear stability theorem is applied to these schemes in order to derive a necessary and sufficient condition for the finite element method. A technique is proposed to render the described approximations total variation-stable by applying the flux limiters to the nonlinear terms of the difference equation dimension by dimension. An entropy theorem applying to the approximations is proved, and an implicit, forward Euler-type time discretization of the approximation is presented. Results of some numerical experiments using the approximations are reported.

  1. Spatial Dimension as a Variable in Quantum Mechanics

    NASA Astrophysics Data System (ADS)

    Doren, Douglas James

    Several approximation methods potentially useful in electronic structure calculations are developed. These methods all treat the spatial dimension, D, as a variable. In an Introduction, the motivations for these methods are described, with special attention to the semiclassical 1/D expansion. Several terms in this expansion have been calculated for two-electron atoms. The results have qualitative appeal but poor convergence properties when D = 3. Chapter 1 shows that this convergence problem is due to singularities in the energy at D = 1 and a method of removing their effects is demonstrated. Chapter 2 treats several model problems, showing how to identify special dimensions at which the energy becomes singular or the Hamiltonian simplifies. Expansions are developed about these special finite values of D which are quite accurate at low order, regardless of the physical parameters of the Hamiltonian. In Chapter 3, expansions about singular points in the energy at finite values of D are used to resum the 1/D series in cases where its leading orders are not sufficient. This leads to a hybrid expansion which typically improves on both the 1/D and the finite D series. These methods are applied in Chapter 4 to two -electron atoms. The ground state energy of few-electron systems is dominated by the presence of a pole when D = 1. The residue of this pole is determined by the eigenvalue of a simple limiting Schrodinger equation. The limit and first order correction are determined for both unapproximated nonrelativistic two-electron atoms and the Hartree-Fock approximation to them. The hybrid expansion using only the first few terms in the 1/D series determines the energy at arbitrary D, providing estimates accurate to four or five figures when D = 3. Degeneracies between D = 3 states and those in nonphysical dimensions are developed in Chapter 5 which provide additional applications for this series. Chapter 6 illustrates these methods in an application to the H(' -) ion, an especially stringent test case. Proposals for future work in this field are described in the final chapter.

  2. Comparison of dynamical approximation schemes for nonlinear gravitaional clustering

    NASA Technical Reports Server (NTRS)

    Melott, Adrian L.

    1994-01-01

    We have recently conducted a controlled comparison of a number of approximations for gravitational clustering against the same n-body simulations. These include ordinary linear perturbation theory (Eulerian), the lognormal approximation, the adhesion approximation, the frozen-flow approximation, the Zel'dovich approximation (describable as first-order Lagrangian perturbation theory), and its second-order generalization. In the last two cases we also created new versions of the approximation by truncation, i.e., by smoothing the initial conditions with various smoothing window shapes and varying their sizes. The primary tool for comparing simulations to approximation schemes was cross-correlation of the evolved mass density fields, testing the extent to which mass was moved to the right place. The Zel'dovich approximation, with initial convolution with a Gaussian e(exp -k(exp 2)/k(sub G(exp 2)), where k(sub G) is adjusted to be just into the nonlinear regime of the evolved model (details in text) worked extremely well. Its second-order generalization worked slightly better. We recommend either n-body simulations or our modified versions of the Zel'dovich approximation, depending upon the purpose. The theoretical implication is that pancaking is implicit in all cosmological gravitational clustering, at least from Gaussian initial conditions, even when subcondensations are present. This in turn provides a natural explanation for the presence of sheets and filaments in the observed galaxy distribution. Use of the approximation scheme can permit extremely rapid generation of large numbers of realizations of model universes with good accuracy down to galaxy group mass scales.

  3. Theory of polyelectrolytes in solvents.

    PubMed

    Chitanvis, Shirish M

    2003-12-01

    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 separations and attractive at longer distances. The chemical potential can be derived from this potential. When the chemical potential is positive, it leads to a meltlike state. For a vanishingly low concentration of segments, this state exhibits scaling behavior for long chains. The Flory exponent characterizing the radius of gyration for long chains is calculated to be approximately 0.63, close to the classical value obtained for second order phase transitions. For short chains, the radius of gyration varies linearly with N, the chain length, and is sensitive to the parameters in the interaction potential. The linear dependence on the chain length N indicates a stiff behavior. The chemical potential associated with this interaction changes sign, when the screening length in the ionic solvent exceeds a critical value. This leads to condensation when the chemical potential is negative. In this state, it is shown using the mean-field approximation that spherical and toroidal condensed shapes can be obtained. The thickness of the toroidal polyelectrolyte is studied as a function of the parameters of the model, such as the ionic screening length. The predictions of this theory should be amenable to experimental verification.

  4. Diffusion in random networks: Asymptotic properties, and numerical and engineering approximations

    NASA Astrophysics Data System (ADS)

    Padrino, Juan C.; Zhang, Duan Z.

    2016-11-01

    The ensemble phase averaging technique is applied to model mass transport by diffusion in random networks. The system consists of an ensemble of random networks, where each network is made of a set of pockets connected by tortuous channels. Inside a channel, we assume that fluid transport is governed by the one-dimensional diffusion equation. Mass balance leads to an integro-differential equation for the pores mass density. The so-called dual porosity model is found to be equivalent to the leading order approximation of the integration kernel when the diffusion time scale inside the channels is small compared to the macroscopic time scale. As a test problem, we consider the one-dimensional mass diffusion in a semi-infinite domain, whose solution is sought numerically. Because of the required time to establish the linear concentration profile inside a channel, for early times the similarity variable is xt- 1 / 4 rather than xt- 1 / 2 as in the traditional theory. This early time sub-diffusive similarity can be explained by random walk theory through the network. In addition, by applying concepts of fractional calculus, we show that, for small time, the governing equation reduces to a fractional diffusion equation with known solution. We recast this solution in terms of special functions easier to compute. Comparison of the numerical and exact solutions shows excellent agreement.

  5. Second-order numerical solution of time-dependent, first-order hyperbolic equations

    NASA Technical Reports Server (NTRS)

    Shah, Patricia L.; Hardin, Jay

    1995-01-01

    A finite difference scheme is developed to find an approximate solution of two similar hyperbolic equations, namely a first-order plane wave and spherical wave problem. Finite difference approximations are made for both the space and time derivatives. The result is a conditionally stable equation yielding an exact solution when the Courant number is set to one.

  6. Estimating short-period dynamics using an extended Kalman filter

    NASA Technical Reports Server (NTRS)

    Bauer, Jeffrey E.; Andrisani, Dominick

    1990-01-01

    An extended Kalman filter (EKF) is used to estimate the parameters of a low-order model from aircraft transient response data. The low-order model is a state space model derived from the short-period approximation of the longitudinal aircraft dynamics. The model corresponds to the pitch rate to stick force transfer function currently used in flying qualities analysis. Because of the model chosen, handling qualities information is also obtained. The parameters are estimated from flight data as well as from a six-degree-of-freedom, nonlinear simulation of the aircraft. These two estimates are then compared and the discrepancies noted. The low-order model is able to satisfactorily match both flight data and simulation data from a high-order computer simulation. The parameters obtained from the EKF analysis of flight data are compared to those obtained using frequency response analysis of the flight data. Time delays and damping ratios are compared and are in agreement. This technique demonstrates the potential to determine, in near real time, the extent of differences between computer models and the actual aircraft. Precise knowledge of these differences can help to determine the flying qualities of a test aircraft and lead to more efficient envelope expansion.

  7. Velocity and thermal slip effects on MHD third order blood flow in an irregular channel though a porous medium with homogeneous/ heterogeneous reactions

    NASA Astrophysics Data System (ADS)

    Gnaneswara Reddy, M.

    2017-09-01

    This communication presents the transportation of third order hydromagnetic fluid with thermal radiation by peristalsis through an irregular channel configuration filled a porous medium under the low Reynolds number and large wavelength approximations. Joule heating, Hall current and homogeneous-heterogeneous reactions effects are considered in the energy and species equations. The Second-order velocity and energy slip restrictions are invoked. Final dimensionless governing transport equations along the boundary restrictions are resolved numerically with the help of NDsolve in Mathematica package. Impact of involved sundry parameters on the non-dimensional axial velocity, fluid temperature and concentration characteristics have been analyzed via plots and tables. It is manifest that an increasing porosity parameter leads to maximum velocity in the core part of the channel. Fluid velocity boosts near the walls of the channel where as the reverse effect in the central part of the channel for higher values of first order slip. Larger values of thermal radiation parameter R reduce the fluid temperature field. Also, an increase in heterogeneous reaction parameter Ks magnifies the concentration profile. The present study has the crucial application of thermal therapy in biomedical engineering.

  8. Spatial inhomogeneities in ionic liquids, charged proteins, and charge stabilized colloids from collective variables theory.

    PubMed

    Patsahan, O; Ciach, A

    2012-09-01

    Effects of size and charge asymmetry between oppositely charged ions or particles on spatial inhomogeneities are studied for a large range of charge and size ratios. We perform a stability analysis of the primitive model of ionic systems with respect to periodic ordering using the collective variables-based theory. We extend previous studies [Ciach et al., Phys. Rev. E 75, 051505 (2007)] in several ways. First, we employ a nonlocal approximation for the reference hard-sphere fluid which leads to the Percus-Yevick pair direct correlation functions for the uniform case. Second, we use the Weeks-Chandler-Anderson regularization scheme for the Coulomb potential inside the hard core. We determine the relevant order parameter connected with the periodic ordering and analyze the character of the dominant fluctuations along the λ lines. We show that the above-mentioned modifications produce large quantitative and partly qualitative changes in the phase diagrams obtained previously. We discuss possible scenarios of the periodic ordering for the whole range of size and charge ratios of the two ionic species, covering electrolytes, ionic liquids, charged globular proteins or nanoparticles in aqueous solutions, and charge-stabilized colloids.

  9. Anomalous transport from holography: part II

    NASA Astrophysics Data System (ADS)

    Bu, Yanyan; Lublinsky, Michael; Sharon, Amir

    2017-03-01

    This is a second study of chiral anomaly-induced transport within a holographic model consisting of anomalous U(1)_V× U(1)_A Maxwell theory in Schwarzschild-AdS_5 spacetime. In the first part, chiral magnetic/separation effects (CME/CSE) are considered in the presence of a static spatially inhomogeneous external magnetic field. Gradient corrections to CME/CSE are analytically evaluated up to third order in the derivative expansion. Some of the third order gradient corrections lead to an anomaly-induced negative B^2-correction to the diffusion constant. We also find modifications to the chiral magnetic wave nonlinear in B. In the second part, we focus on the experimentally interesting case of the axial chemical potential being induced dynamically by a constant magnetic and time-dependent electric fields. Constitutive relations for the vector/axial currents are computed employing two different approximations: (a) derivative expansion (up to third order) but fully nonlinear in the external fields, and (b) weak electric field limit but resuming all orders in the derivative expansion. A non-vanishing nonlinear axial current (CSE) is found in the first case. The dependence on magnetic field and frequency of linear transport coefficient functions is explored in the second.

  10. Frame-dependence of higher-order inflationary observables in scalar-tensor theories

    NASA Astrophysics Data System (ADS)

    Karam, Alexandros; Pappas, Thomas; Tamvakis, Kyriakos

    2017-09-01

    In the context of scalar-tensor theories of gravity we compute the third-order corrected spectral indices in the slow-roll approximation. The calculation is carried out by employing the Green's function method for scalar and tensor perturbations in both the Einstein and Jordan frames. Then, using the interrelations between the Hubble slow-roll parameters in the two frames we find that the frames are equivalent up to third order. Since the Hubble slow-roll parameters are related to the potential slow-roll parameters, we express the observables in terms of the latter which are manifestly invariant. Nevertheless, the same inflaton excursion leads to different predictions in the two frames since the definition of the number of e -folds differs. To illustrate this effect we consider a nonminimal inflationary model and find that the difference in the predictions grows with the nonminimal coupling, and it can actually be larger than the difference between the first and third order results for the observables. Finally, we demonstrate the effect of various end-of-inflation conditions on the observables. These effects will become important for the analyses of inflationary models in view of the improved sensitivity of future experiments.

  11. Mean-field theory of baryonic matter for QCD in the large Nc and heavy quark mass limits

    NASA Astrophysics Data System (ADS)

    Adhikari, Prabal; Cohen, Thomas D.

    2013-11-01

    We discuss theoretical issues pertaining to baryonic matter in the combined heavy-quark and large Nc limits of QCD. Witten's classic argument that baryons and interacting systems of baryons can be described in a mean-field approximation with each of the quarks moving in an average potential due to the remaining quarks is heuristic. It is important to justify this heuristic description for the case of baryonic matter since systems of interacting baryons are intrinsically more complicated than single baryons due to the possibility of hidden color states—states in which the subsystems making up the entire baryon crystal are not color-singlet nucleons but rather colorful states coupled together to make a color-singlet state. In this work, we provide a formal justification of this heuristic prescription. In order to do this, we start by taking the heavy quark limit, thus effectively reducing the problem to a many-body quantum mechanical system. This problem can be formulated in terms of integrals over coherent states, which for this problem are simple Slater determinants. We show that for the many-body problem, the support region for these integrals becomes narrow at large Nc, yielding an energy which is well approximated by a single coherent state—that is a mean-field description. Corrections to the energy are of relative order 1/Nc. While hidden color states are present in the exact state of the heavy quark system, they only influence the interaction energy below leading order in 1/Nc.

  12. Electroencephalography in ellipsoidal geometry with fourth-order harmonics.

    PubMed

    Alcocer-Sosa, M; Gutierrez, D

    2016-08-01

    We present a solution to the electroencephalographs (EEG) forward problem of computing the scalp electric potentials for the case when the head's geometry is modeled using a four-shell ellipsoidal geometry and the brain sources with an equivalent current dipole (ECD). The proposed solution includes terms up to the fourth-order ellipsoidal harmonics and we compare this new approximation against those that only considered up to second- and third-order harmonics. Our comparisons use as reference a solution in which a tessellated volume approximates the head and the forward problem is solved through the boundary element method (BEM). We also assess the solution to the inverse problem of estimating the magnitude of an ECD through different harmonic approximations. Our results show that the fourth-order solution provides a better estimate of the ECD in comparison to lesser order ones.

  13. The 4th order GISS model of the global atmosphere

    NASA Technical Reports Server (NTRS)

    Kalnay-Rivas, E.; Bayliss, A.; Storch, J.

    1977-01-01

    The new GISS 4th order model of the global atmosphere is described. It is based on 4th order quadratically conservative differences with the periodic application of a 16th order filter on the sea level pressure and potential temperature equations, a combination which is approximately enstrophy conserving. Several short range forecasts indicate a significant improvement over 2nd order forecasts with the same resolution (approximately 400 km). However the 4th order forecasts are somewhat inferior to 2nd order forecasts with double resolution. This is probably due to the presence of short waves in the range between 1000 km and 2000 km, which are computed more accurately by the 2nd order high resolution model. An operation count of the schemes indicates that with similar code optimization, the 4th order model will require approximately the same amount of computer time as the 2nd order model with the same resolution. It is estimated that the 4th order model with a grid size of 200 km provides enough accuracy to make horizontal truncation errors negligible over a period of a week for all synoptic scales (waves longer than 1000 km).

  14. Fluid flow in a spiral microfluidic duct

    NASA Astrophysics Data System (ADS)

    Harding, Brendan; Stokes, Yvonne

    2018-04-01

    We consider the steady, pressure driven flow of a viscous fluid through a microfluidic device having the geometry of a planar spiral duct with a slowly varying curvature and height smaller than width. For this problem, it is convenient to express the Navier-Stokes equations in terms of a non-orthogonal coordinate system. Then, after applying appropriate scalings, the leading order equations admit a relatively simple solution in the central region of the duct cross section. First-order corrections with respect to the duct curvature and aspect ratio parameters are also obtained for this region. Additional correction terms are needed to ensure that no slip and no penetration conditions are satisfied on the side walls. Our solutions allow for a top wall shape that varies with respect to the radial coordinate which allows us to study the flow in a variety of cross-sectional shapes, including trapezoidal-shaped ducts that have been studied experimentally. At leading order, the flow is found to depend on the local height and slope of the top wall within the central region. The solutions are compared with numerical approximations of a classical Dean flow and are found to be in good agreement for a small duct aspect ratio and a slowly varying and small curvature. We conclude that the slowly varying curvature typical of spiral microfluidic devices has a negligible impact on the flow in the sense that locally the flow does not differ significantly from the classical Dean flow through a duct having the same curvature.

  15. How perfect can a gluon plasma be in perturbative QCD?

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Chen, Jiunn-Wei; Deng Jian; Dong Hui

    2011-02-01

    The shear viscosity to entropy density ratio, {eta}/s, characterizes how perfect a fluid is. We calculate the leading order {eta}/s of a gluon plasma in perturbation using the kinetic theory. The leading order contribution only involves the elastic gg{r_reversible}gg (22) process and the inelastic gg{r_reversible}ggg (23) process. The hard-thermal-loop (HTL) treatment is used for the 22 matrix element, while the exact matrix element in vacuum is supplemented by the gluon Debye mass insertion for the 23 process. Also, the asymptotic mass is used for the external gluons in the kinetic theory. The errors from not implementing HTL and the Landau-Pomeranchuk-Migdalmore » effect in the 23 process, and from the uncalculated higher order corrections, are estimated. Our result smoothly connects the two different approximations used by Arnold, Moore, and Yaffe (AMY) and Xu and Greiner (XG). At small {alpha}{sub s} ({alpha}{sub s}<<1), our result is closer to AMY's collinear result while at larger {alpha}{sub s} the finite angle noncollinear configurations become more important and our result is closer to XG's soft bremsstrahlung result. In the region where perturbation is reliable ({alpha}{sub s} < or approx. 0.1), we find no indication that the proposed perfect fluid limit {eta}/s{approx_equal}1/(4{pi}) can be achieved by perturbative QCD alone. Whether this can be achieve for {alpha}{sub s} > or approx. 0.1 is still an open question.« less

  16. Singularity-free next-to-leading order ΔS = 1 renormalization group evolution and ɛ K ' /ɛK in the Standard Model and beyond

    NASA Astrophysics Data System (ADS)

    Kitahara, Teppei; Nierste, Ulrich; Tremper, Paul

    2016-12-01

    The standard analytic solution of the renormalization group (RG) evolution for the Δ S = 1 Wilson coefficients involves several singularities, which complicate analytic solutions. In this paper we derive a singularity-free solution of the next-to-leading order (NLO) RG equations, which greatly facilitates the calculation of ɛ K ' , the measure of direct CP violation in K → ππ decays. Using our new RG evolution and the latest lattice results for the hadronic matrix elements, we calculate the ratio ɛ K ' /ɛ K (with ɛ K quantifying indirect CP violation) in the Standard Model (SM) at NLO to ɛ K ' /ɛ K = (1.06 ± 5.07) × 10- 4, which is 2 .8 σ below the experimental value. We also present the evolution matrix in the high-energy regime for calculations of new physics contributions and derive easy-to-use approximate formulae. We find that the RG amplification of new-physics contributions to Wilson coefficients of the electroweak penguin operators is further enhanced by the NLO corrections: if the new contribution is generated at the scale of 1-10 TeV, the RG evolution between the new-physics scale and the electroweak scale enhances these coefficients by 50-100%. Our solution contains a term of order α EM 2 / α s 2 , which is numerically unimportant for the SM case but should be included in studies of high-scale new-physics.

  17. Raman scattering of IrTe2

    NASA Astrophysics Data System (ADS)

    Lee, Alexander; Thorsmolle, Verner; Artyukhin, Sergey; Yang, Jun; Cheong, Sang-Wook; Blumberg, Girsh

    2014-03-01

    IrTe2 presents a layered compound with a triangular lattice. It is known to exhibit a first order structural phase transition at approximately 260 K which is of a first order, corresponding to a formation of a superstructure with a period of five unit cells. Using polarized Raman spectroscopy we have studied the temperature dependence of 14 observed Raman allowed phononic modes. These phonons couple strongly to this transition and one additional first order transition at approximately 170 K. In the high-temperature phase only 3 modes are observed, while below approximately 280 K all 14 modes become visible. Below approximately 170 K only 11 modes are observed. Our results shed light on the possible mechanism driving the transitions. ACL, VKT and GB acknowledge support by NSF DMR-1104884.

  18. Highly Accurate Analytical Approximate Solution to a Nonlinear Pseudo-Oscillator

    NASA Astrophysics Data System (ADS)

    Wu, Baisheng; Liu, Weijia; Lim, C. W.

    2017-07-01

    A second-order Newton method is presented to construct analytical approximate solutions to a nonlinear pseudo-oscillator in which the restoring force is inversely proportional to the dependent variable. The nonlinear equation is first expressed in a specific form, and it is then solved in two steps, a predictor and a corrector step. In each step, the harmonic balance method is used in an appropriate manner to obtain a set of linear algebraic equations. With only one simple second-order Newton iteration step, a short, explicit, and highly accurate analytical approximate solution can be derived. The approximate solutions are valid for all amplitudes of the pseudo-oscillator. Furthermore, the method incorporates second-order Taylor expansion in a natural way, and it is of significant faster convergence rate.

  19. Short-range second order screened exchange correction to RPA correlation energies

    NASA Astrophysics Data System (ADS)

    Beuerle, Matthias; Ochsenfeld, Christian

    2017-11-01

    Direct random phase approximation (RPA) correlation energies have become increasingly popular as a post-Kohn-Sham correction, due to significant improvements over DFT calculations for properties such as long-range dispersion effects, which are problematic in conventional density functional theory. On the other hand, RPA still has various weaknesses, such as unsatisfactory results for non-isogyric processes. This can in parts be attributed to the self-correlation present in RPA correlation energies, leading to significant self-interaction errors. Therefore a variety of schemes have been devised to include exchange in the calculation of RPA correlation energies in order to correct this shortcoming. One of the most popular RPA plus exchange schemes is the second order screened exchange (SOSEX) correction. RPA + SOSEX delivers more accurate absolute correlation energies and also improves upon RPA for non-isogyric processes. On the other hand, RPA + SOSEX barrier heights are worse than those obtained from plain RPA calculations. To combine the benefits of RPA correlation energies and the SOSEX correction, we introduce a short-range RPA + SOSEX correction. Proof of concept calculations and benchmarks showing the advantages of our method are presented.

  20. Short-range second order screened exchange correction to RPA correlation energies.

    PubMed

    Beuerle, Matthias; Ochsenfeld, Christian

    2017-11-28

    Direct random phase approximation (RPA) correlation energies have become increasingly popular as a post-Kohn-Sham correction, due to significant improvements over DFT calculations for properties such as long-range dispersion effects, which are problematic in conventional density functional theory. On the other hand, RPA still has various weaknesses, such as unsatisfactory results for non-isogyric processes. This can in parts be attributed to the self-correlation present in RPA correlation energies, leading to significant self-interaction errors. Therefore a variety of schemes have been devised to include exchange in the calculation of RPA correlation energies in order to correct this shortcoming. One of the most popular RPA plus exchange schemes is the second order screened exchange (SOSEX) correction. RPA + SOSEX delivers more accurate absolute correlation energies and also improves upon RPA for non-isogyric processes. On the other hand, RPA + SOSEX barrier heights are worse than those obtained from plain RPA calculations. To combine the benefits of RPA correlation energies and the SOSEX correction, we introduce a short-range RPA + SOSEX correction. Proof of concept calculations and benchmarks showing the advantages of our method are presented.

  1. Magnetized Target Fusion Driven by Plasma Liners

    NASA Technical Reports Server (NTRS)

    Thio, Y. C. Francis; Kirkpatrick, Ronald C.; Knapp, Charles E.; Rodgers, Stephen L. (Technical Monitor)

    2002-01-01

    Magnetized target fusion is an emerging, relatively unexplored approach to fusion for electrical power and propulsion application. The physical principles of the concept are founded upon both inertial confinement fusion (ICF) and magnetic confinement fusion (MCF). It attempts to combine the favorable attributes of both these orthogonal approaches to fusion, but at the same time, avoiding the extreme technical challenges of both by exploiting a fusion regime intermediate between them. It uses a material liner to compress, heat and contain the fusion reacting plasma (the target plasma) mentally. By doing so, the fusion burn could be made to occur at plasma densities as high as six orders of magnitude higher than conventional MCF such as tokamak, thus leading to an approximately three orders of magnitude reduction in the plasma energy required for ignition. It also uses a transient magnetic field, compressed to extremely high intensity (100's T to 1000T) in the target plasma, to slow down the heat transport to the liner and to increase the energy deposition of charged-particle fusion products. This has several compounding beneficial effects. It leads to longer energy confinement time compared with conventional ICF without magnetized target, and thus permits the use of much lower plasma density to produce reasonable burn-up fraction. The compounding effects of lower plasma density and the magneto-insulation of the target lead to greatly reduced compressional heating power on the target. The increased energy deposition rate of charged-particle fusion products also helps to lower the energy threshold required for ignition and increasing the burn-up fraction. The reduction in ignition energy and the compressional power compound to lead to reduced system size, mass and R&D cost. It is a fusion approach that has an affordable R&D pathway, and appears attractive for propulsion application in the nearer term.

  2. Flow in linearly sheared two-dimensional foams: From bubble to bulk scale.

    PubMed

    Katgert, Gijs; Latka, Andrzej; Möbius, Matthias E; van Hecke, Martin

    2009-06-01

    We probe the flow of two-dimensional (2D) foams, consisting of a monolayer of bubbles sandwiched between a liquid bath and glass plate, as a function of driving rate, packing fraction, and degree of disorder. First, we find that bidisperse, disordered foams exhibit strongly rate-dependent and inhomogeneous (shear-banded) velocity profiles, while monodisperse ordered foams are also shear banded but essentially rate independent. Second, we adapt a simple model [E. Janiaud, D. Weaire, and S. Hutzler, Phys. Rev. Lett. 97, 038302 (2006)] based on balancing the averaged drag forces between the bubbles and the top plate F[over ]_{bw} and the averaged bubble-bubble drag forces F[over ]_{bb} by assuming that F[over ]_{bw} approximately v;{2/3} and F[over ]_{bb} approximately ( partial differential_{y}v);{beta} , where v and ( partial differential_{y}v) denote average bubble velocities and gradients. This model captures the observed rate-dependent flows for beta approximately 0.36 , and the rate independent flows for beta approximately 0.67 . Third, we perform independent rheological measurements of F[over ]_{bw} and F[over ]_{bb} , both for ordered and disordered systems, and find these to be fully consistent with the forms assumed in the simple model. Disorder thus leads to a modified effective exponent beta . Fourth, we vary the packing fraction phi of the foam over a substantial range and find that the flow profiles become increasingly shear banded when the foam is made wetter. Surprisingly, the model describes flow profiles and rate dependence over the whole range of packing fractions with the same power-law exponents-only a dimensionless number k that measures the ratio of the prefactors of the viscous drag laws is seen to vary with packing fraction. We find that k approximately (phi-phi_{c});{-1} , where phi_{c} approximately 0.84 corresponds to the 2D jamming density, and suggest that this scaling follows from the geometry of the deformed facets between bubbles in contact. Overall, our work shows that the presence of disorder qualitatively changes the effective bubble-bubble drag forces and suggests a route to rationalize aspects of the ubiquitous Herschel-Bulkley (power-law) rheology observed in a wide range of disordered materials.

  3. Pitch angle scattering of relativistic electrons from stationary magnetic waves: Continuous Markov process and quasilinear theory

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Lemons, Don S.

    2012-01-15

    We develop a Markov process theory of charged particle scattering from stationary, transverse, magnetic waves. We examine approximations that lead to quasilinear theory, in particular the resonant diffusion approximation. We find that, when appropriate, the resonant diffusion approximation simplifies the result of the weak turbulence approximation without significant further restricting the regime of applicability. We also explore a theory generated by expanding drift and diffusion rates in terms of a presumed small correlation time. This small correlation time expansion leads to results valid for relatively small pitch angle and large wave energy density - a regime that may govern pitchmore » angle scattering of high-energy electrons into the geomagnetic loss cone.« less

  4. Measurement of double-differential cross sections for top quark pair production in pp collisions at $$\\sqrt{s} = 8$$ TeV and impact on parton distribution functions

    DOE PAGES

    Sirunyan, A. M.; Tumasyan, A.; Adam, W.; ...

    2017-07-11

    Normalized double-differential cross sections for top quark pair (more » $$\\mathrm{t}\\overline{\\mathrm{t}}$$ ) production are measured in pp collisions at a centre-of-mass energy of 8 $$\\,\\text {TeV}$$ with the CMS experiment at the LHC. The analyzed data correspond to an integrated luminosity of 19.7 $$\\,\\text {fb}^{-1}$$ . The measurement is performed in the dilepton $$\\mathrm {e}^{\\pm }\\mu ^{\\mp }$$ final state. The $$\\mathrm{t}\\overline{\\mathrm{t}}$$ cross section is determined as a function of various pairs of observables characterizing the kinematics of the top quark and $$\\mathrm{t}\\overline{\\mathrm{t}}$$ system. The data are compared to calculations using perturbative quantum chromodynamics at next-to-leading and approximate next-to-next-to-leading orders. They are also compared to predictions of Monte Carlo event generators that complement fixed-order computations with parton showers, hadronization, and multiple-parton interactions. Overall agreement is observed with the predictions, which is improved when the latest global sets of proton parton distribution functions are used. Lastly, the inclusion of the measured $$\\mathrm{t}\\overline{\\mathrm{t}}$$ cross sections in a fit of parametrized parton distribution functions is shown to have significant impact on the gluon distribution.« less

  5. On the nonexistence of degenerate phase-shift discrete solitons in a dNLS nonlocal lattice

    NASA Astrophysics Data System (ADS)

    Penati, T.; Sansottera, M.; Paleari, S.; Koukouloyannis, V.; Kevrekidis, P. G.

    2018-05-01

    We consider a one-dimensional discrete nonlinear Schrödinger (dNLS) model featuring interactions beyond nearest neighbors. We are interested in the existence (or nonexistence) of phase-shift discrete solitons, which correspond to four-site vortex solutions in the standard two-dimensional dNLS model (square lattice), of which this is a simpler variant. Due to the specific choice of lengths of the inter-site interactions, the vortex configurations considered present a degeneracy which causes the standard continuation techniques to be non-applicable. In the present one-dimensional case, the existence of a conserved quantity for the soliton profile (the so-called density current), together with a perturbative construction, leads to the nonexistence of any phase-shift discrete soliton which is at least C2 with respect to the small coupling ɛ, in the limit of vanishing ɛ. If we assume the solution to be only C0 in the same limit of ɛ, nonexistence is instead proved by studying the bifurcation equation of a Lyapunov-Schmidt reduction, expanded to suitably high orders. Specifically, we produce a nonexistence criterion whose efficiency we reveal in the cases of partial and full degeneracy of approximate solutions obtained via a leading order expansion.

  6. Halo effective field theory constrains the solar 7Be + p → 8B + γ rate

    DOE PAGES

    Zhang, Xilin; Nollett, Kenneth M.; Phillips, D. R.

    2015-11-06

    In this study, we report an improved low-energy extrapolation of the cross section for the process 7Be(p,γ) 8B, which determines the 8B neutrino flux from the Sun. Our extrapolant is derived from Halo Effective Field Theory (EFT) at next-to-leading order. We apply Bayesian methods to determine the EFT parameters and the low-energy S-factor, using measured cross sections and scattering lengths as inputs. Asymptotic normalization coefficients of 8B are tightly constrained by existing radiative capture data, and contributions to the cross section beyond external direct capture are detected in the data at E < 0.5 MeV. Most importantly, the S-factor atmore » zero energy is constrained to be S(0) = 21.3 ± 0.7 eV b, which is an uncertainty smaller by a factor of two than previously recommended. That recommendation was based on the full range for S(0) obtained among a discrete set of models judged to be reasonable. In contrast, Halo EFT subsumes all models into a controlled low-energy approximant, where they are characterized by nine parameters at next-to-leading order. These are fit to data, and marginalized over via Monte Carlo integration to produce the improved prediction for S(E).« less

  7. (Small) Resonant non-Gaussianities: Signatures of a Discrete Shift Symmetry in the Effective Field Theory of Inflation

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Behbahani, Siavosh R.; /SLAC /Stanford U., Phys. Dept. /Boston U.; Dymarsky, Anatoly

    2012-06-06

    We apply the Effective Field Theory of Inflation to study the case where the continuous shift symmetry of the Goldstone boson {pi} is softly broken to a discrete subgroup. This case includes and generalizes recently proposed String Theory inspired models of Inflation based on Axion Monodromy. The models we study have the property that the 2-point function oscillates as a function of the wavenumber, leading to oscillations in the CMB power spectrum. The non-linear realization of time diffeomorphisms induces some self-interactions for the Goldstone boson that lead to a peculiar non-Gaussianity whose shape oscillates as a function of the wavenumber.more » We find that in the regime of validity of the effective theory, the oscillatory signal contained in the n-point correlation functions, with n > 2, is smaller than the one contained in the 2-point function, implying that the signature of oscillations, if ever detected, will be easier to find first in the 2-point function, and only then in the higher order correlation functions. Still the signal contained in higher-order correlation functions, that we study here in generality, could be detected at a subleading level, providing a very compelling consistency check for an approximate discrete shift symmetry being realized during inflation.« less

  8. Hard gamma radiation background from coding collimator of gamma telescope under space experiment conditions

    NASA Astrophysics Data System (ADS)

    Aleksandrov, A. P.; Berezovoy, A. N.; Galper, A. M.; Grachev, V. M.; Dmitrenko, V. V.; Kirillov-Ugryumov, V. G.; Lebedev, V. V.; Lyakhov, V. A.; Moiseyev, A. A.; Ulin, S. Y.

    1985-09-01

    Coding collimators are used to improve the angular resolution of gamma-ray telescopes at energies above 50 MeV. However, the interaction of cosmic rays with the collimation material can lead to the appearance of a gamma-ray background flux which can have a deleterious effect on measurement efficiency. An experiment was performed on the Salyut-6-Soyuz spacecraft system with the Elena-F small-scale gamma-ray telescope in order to measure the magnitude of this background. It is shown that, even at a zenith angle of approximately zero degrees (the angle at which the gamma-ray observations are made), the coding collimator has only an insignificant effect on the background conditions.

  9. First Lattice Calculation of the QED Corrections to Leptonic Decay Rates

    NASA Astrophysics Data System (ADS)

    Giusti, D.; Lubicz, V.; Tarantino, C.; Martinelli, G.; Sachrajda, C. T.; Sanfilippo, F.; Simula, S.; Tantalo, N.

    2018-02-01

    The leading-order electromagnetic and strong isospin-breaking corrections to the ratio of Kμ 2 and πμ 2 decay rates are evaluated for the first time on the lattice, following a method recently proposed. The lattice results are obtained using the gauge ensembles produced by the European Twisted Mass Collaboration with Nf=2 +1 +1 dynamical quarks. Systematic effects are evaluated and the impact of the quenched QED approximation is estimated. Our result for the correction to the tree-level Kμ 2/πμ 2 decay ratio is -1.22 (16 )%, to be compared to the estimate of -1.12 (21 )% based on chiral perturbation theory and adopted by the Particle Data Group.

  10. NNLO corrections to top pair production at hadron colliders: the quark-gluon reaction

    NASA Astrophysics Data System (ADS)

    Czakon, Michal; Mitov, Alexander

    2013-01-01

    We compute the next-to-next-to-leading order QCD correction to the total inclusive top pair production cross-section in the reaction qgto toverline{t}+X . We find moderate {O} (1%) correction to central values at both Tevatron and LHC. The scale variation of the cross-section remains unchanged at the Tevatron and is significantly reduced at the LHC. We find that recently introduced approximation based on the high-energy limit of the top pair cross-section significantly deviates from the exact result. The results derived in the present work are included in version 1.4 of the program Top++. Work towards computing the reaction ggto toverline{t}+X is ongoing.

  11. Asymptotic boundary conditions for dissipative waves: General theory

    NASA Technical Reports Server (NTRS)

    Hagstrom, Thomas

    1990-01-01

    An outstanding issue in the computational analysis of time dependent problems is the imposition of appropriate radiation boundary conditions at artificial boundaries. Accurate conditions are developed which are based on the asymptotic analysis of wave propagation over long ranges. Employing the method of steepest descents, dominant wave groups are identified and simple approximations to the dispersion relation are considered in order to derive local boundary operators. The existence of a small number of dominant wave groups may be expected for systems with dissipation. Estimates of the error as a function of domain size are derived under general hypotheses, leading to convergence results. Some practical aspects of the numerical construction of the asymptotic boundary operators are also discussed.

  12. Evolution of the fogwater composition in Strasbourg (France) from 1990 to 1999

    NASA Astrophysics Data System (ADS)

    Herckes, Pierre; Wortham, Henri; Mirabel, Philippe; Millet, Maurice

    The chemical composition of fogwater has been studied in the city of Strasbourg (France) from 1990 to 1999. During these years, fogwater samples have been collected and analysed for major ions and trace metals. This paper reports on the analysis of the collected dataset. The analysis revealed a significant decrease in acidity of approximately one pH unit over the course of the study. This decrease in acidity appears to be linked to a decrease in SO 2(g) and the resulting SO 42-. Trace metal concentrations have also strongly decreased over the 10-year period. Pb concentrations, following the elimination of leaded gasoline, decreased by more than one order of magnitude.

  13. Large-scale anisotropy of the cosmic microwave background radiation

    NASA Technical Reports Server (NTRS)

    Silk, J.; Wilson, M. L.

    1981-01-01

    Inhomogeneities in the large-scale distribution of matter inevitably lead to the generation of large-scale anisotropy in the cosmic background radiation. The dipole, quadrupole, and higher order fluctuations expected in an Einstein-de Sitter cosmological model have been computed. The dipole and quadrupole anisotropies are comparable to the measured values, and impose important constraints on the allowable spectrum of large-scale matter density fluctuations. A significant dipole anisotropy is generated by the matter distribution on scales greater than approximately 100 Mpc. The large-scale anisotropy is insensitive to the ionization history of the universe since decoupling, and cannot easily be reconciled with a galaxy formation theory that is based on primordial adiabatic density fluctuations.

  14. Dielectric magnetic microparticles as photomagnonic cavities: Enhancing the modulation of near-infrared light by spin waves

    NASA Astrophysics Data System (ADS)

    Almpanis, Evangelos

    2018-05-01

    The coupling between spin waves and optical Mie resonances inside a dielectric magnetic spherical particle, which acts simultaneously as a photonic and magnonic (photomagnonic) cavity, is investigated by means of numerical calculations accurate to arbitrary order in the magnetooptical coupling coefficient. Isolated dielectric magnetic particles with diameters of just a few microns support high-Q optical Mie resonances at near-infrared frequencies and localized spin waves, providing an ultrasmall and compact platform in the emerging field of cavity optomagnonics. Our results predict the occurrence of strong interaction effects, beyond the linear-response approximation, which lead to enhanced modulation of near-infrared light by spin waves through multimagnon absorption and emission mechanisms.

  15. Decoherence dynamics of interacting qubits coupled to a bath of local optical phonons

    NASA Astrophysics Data System (ADS)

    Lone, Muzaffar Qadir; Yarlagadda, S.

    2016-04-01

    We study decoherence in an interacting qubit system described by infinite range Heisenberg model (IRHM) in a situation where the system is coupled to a bath of local optical phonons. Using perturbation theory in polaron frame of reference, we derive an effective Hamiltonian that is valid in the regime of strong spin-phonon coupling under nonadiabatic conditions. It is shown that the effective Hamiltonian commutes with the IRHM upto leading orders of perturbation and thus has the same eigenstates as the IRHM. Using a quantum master equation with Markovian approximation of dynamical evolution, we show that the off-diagonal elements of the density matrix do not decay in the energy eigen basis of IRHM.

  16. Exact closed-form solutions of a fully nonlinear asymptotic two-fluid model

    NASA Astrophysics Data System (ADS)

    Cheviakov, Alexei F.

    2018-05-01

    A fully nonlinear model of Choi and Camassa (1999) describing one-dimensional incompressible dynamics of two non-mixing fluids in a horizontal channel, under a shallow water approximation, is considered. An equivalence transformation is presented, leading to a special dimensionless form of the system, involving a single dimensionless constant physical parameter, as opposed to five parameters present in the original model. A first-order dimensionless ordinary differential equation describing traveling wave solutions is analyzed. Several multi-parameter families of physically meaningful exact closed-form solutions of the two-fluid model are derived, corresponding to periodic, solitary, and kink-type bidirectional traveling waves; specific examples are given, and properties of the exact solutions are analyzed.

  17. Advection modes by optimal mass transfer

    NASA Astrophysics Data System (ADS)

    Iollo, Angelo; Lombardi, Damiano

    2014-02-01

    Classical model reduction techniques approximate the solution of a physical model by a limited number of global modes. These modes are usually determined by variants of principal component analysis. Global modes can lead to reduced models that perform well in terms of stability and accuracy. However, when the physics of the model is mainly characterized by advection, the nonlocal representation of the solution by global modes essentially reduces to a Fourier expansion. In this paper we describe a method to determine a low-order representation of advection. This method is based on the solution of Monge-Kantorovich mass transfer problems. Examples of application to point vortex scattering, Korteweg-de Vries equation, and hurricane Dean advection are discussed.

  18. A non-grey analytical model for irradiated atmospheres. II. Analytical vs. numerical solutions

    NASA Astrophysics Data System (ADS)

    Parmentier, Vivien; Guillot, Tristan; Fortney, Jonathan J.; Marley, Mark S.

    2015-02-01

    Context. The recent discovery and characterization of the diversity of the atmospheres of exoplanets and brown dwarfs calls for the development of fast and accurate analytical models. Aims: We wish to assess the goodness of the different approximations used to solve the radiative transfer problem in irradiated atmospheres analytically, and we aim to provide a useful tool for a fast computation of analytical temperature profiles that remains correct over a wide range of atmospheric characteristics. Methods: We quantify the accuracy of the analytical solution derived in paper I for an irradiated, non-grey atmosphere by comparing it to a state-of-the-art radiative transfer model. Then, using a grid of numerical models, we calibrate the different coefficients of our analytical model for irradiated solar-composition atmospheres of giant exoplanets and brown dwarfs. Results: We show that the so-called Eddington approximation used to solve the angular dependency of the radiation field leads to relative errors of up to ~5% on the temperature profile. For grey or semi-grey atmospheres (i.e., when the visible and thermal opacities, respectively, can be considered independent of wavelength), we show that the presence of a convective zone has a limited effect on the radiative atmosphere above it and leads to modifications of the radiative temperature profile of approximately ~2%. However, for realistic non-grey planetary atmospheres, the presence of a convective zone that extends to optical depths smaller than unity can lead to changes in the radiative temperature profile on the order of 20% or more. When the convective zone is located at deeper levels (such as for strongly irradiated hot Jupiters), its effect on the radiative atmosphere is again on the same order (~2%) as in the semi-grey case. We show that the temperature inversion induced by a strong absorber in the optical, such as TiO or VO is mainly due to non-grey thermal effects reducing the ability of the upper atmosphere to cool down rather than an enhanced absorption of the stellar light as previously thought. Finally, we provide a functional form for the coefficients of our analytical model for solar-composition giant exoplanets and brown dwarfs. This leads to fully analytical pressure-temperature profiles for irradiated atmospheres with a relative accuracy better than 10% for gravities between 2.5 m s-2 and 250 m s-2 and effective temperatures between 100 K and 3000 K. This is a great improvement over the commonly used Eddington boundary condition. A FORTRAN implementation of the analytical model is only available at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (ftp://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/574/A35 or at http://www.oca.eu/parmentier/nongrey.Appendix A is available in electronic form at http://www.aanda.org

  19. Desorption kinetics of hydrophobic organic chemicals from sediment to water: a review of data and models.

    PubMed

    Birdwell, Justin; Cook, Robert L; Thibodeaux, Louis J

    2007-03-01

    Resuspension of contaminated sediment can lead to the release of toxic compounds to surface waters where they are more bioavailable and mobile. Because the timeframe of particle resettling during such events is shorter than that needed to reach equilibrium, a kinetic approach is required for modeling the release process. Due to the current inability of common theoretical approaches to predict site-specific release rates, empirical algorithms incorporating the phenomenological assumption of biphasic, or fast and slow, release dominate the descriptions of nonpolar organic chemical release in the literature. Two first-order rate constants and one fraction are sufficient to characterize practically all of the data sets studied. These rate constants were compared to theoretical model parameters and functionalities, including chemical properties of the contaminants and physical properties of the sorbents, to determine if the trends incorporated into the hindered diffusion model are consistent with the parameters used in curve fitting. The results did not correspond to the parameter dependence of the hindered diffusion model. No trend in desorption rate constants, for either fast or slow release, was observed to be dependent on K(OC) or aqueous solubility for six and seven orders of magnitude, respectively. The same was observed for aqueous diffusivity and sediment fraction organic carbon. The distribution of kinetic rate constant values was approximately log-normal, ranging from 0.1 to 50 d(-1) for the fast release (average approximately 5 d(-1)) and 0.0001 to 0.1 d(-1) for the slow release (average approximately 0.03 d(-1)). The implications of these findings with regard to laboratory studies, theoretical desorption process mechanisms, and water quality modeling needs are presented and discussed.

  20. Impact of spatial resolution on cirrus infrared satellite retrievals in the presence of cloud heterogeneity

    NASA Astrophysics Data System (ADS)

    Fauchez, T.; Platnick, S. E.; Meyer, K.; Zhang, Z.; Cornet, C.; Szczap, F.; Dubuisson, P.

    2015-12-01

    Cirrus clouds are an important part of the Earth radiation budget but an accurate assessment of their role remains highly uncertain. Cirrus optical properties such as Cloud Optical Thickness (COT) and ice crystal effective particle size are often retrieved with a combination of Visible/Near InfraRed (VNIR) and ShortWave-InfraRed (SWIR) reflectance channels. Alternatively, Thermal InfraRed (TIR) techniques, such as the Split Window Technique (SWT), have demonstrated better accuracy for thin cirrus effective radius retrievals with small effective radii. However, current global operational algorithms for both retrieval methods assume that cloudy pixels are horizontally homogeneous (Plane Parallel Approximation (PPA)) and independent (Independent Pixel Approximation (IPA)). The impact of these approximations on ice cloud retrievals needs to be understood and, as far as possible, corrected. Horizontal heterogeneity effects in the TIR spectrum are mainly dominated by the PPA bias that primarily depends on the COT subpixel heterogeneity; for solar reflectance channels, in addition to the PPA bias, the IPA can lead to significant retrieval errors due to a significant photon horizontal transport between cloudy columns, as well as brightening and shadowing effects that are more difficult to quantify. Furthermore TIR retrievals techniques have demonstrated better retrieval accuracy for thin cirrus having small effective radii over solar reflectance techniques. The TIR range is thus particularly relevant in order to characterize, as accurately as possible, thin cirrus clouds. Heterogeneity effects in the TIR are evaluated as a function of spatial resolution in order to estimate the optimal spatial resolution for TIR retrieval applications. These investigations are performed using a cirrus 3D cloud generator (3DCloud), a 3D radiative transfer code (3DMCPOL), and two retrieval algorithms, namely the operational MODIS retrieval algorithm (MOD06) and a research-level SWT algorithm.

  1. Born-Oppenheimer approximation in an effective field theory language

    NASA Astrophysics Data System (ADS)

    Brambilla, Nora; Krein, Gastão; Tarrús Castellà, Jaume; Vairo, Antonio

    2018-01-01

    The Born-Oppenheimer approximation is the standard tool for the study of molecular systems. It is founded on the observation that the energy scale of the electron dynamics in a molecule is larger than that of the nuclei. A very similar physical picture can be used to describe QCD states containing heavy quarks as well as light-quarks or gluonic excitations. In this work, we derive the Born-Oppenheimer approximation for QED molecular systems in an effective field theory framework by sequentially integrating out degrees of freedom living at energies above the typical energy scale where the dynamics of the heavy degrees of freedom occurs. In particular, we compute the matching coefficients of the effective field theory for the case of the H2+ diatomic molecule that are relevant to compute its spectrum up to O (m α5). Ultrasoft photon loops contribute at this order, being ultimately responsible for the molecular Lamb shift. In the effective field theory the scaling of all the operators is homogeneous, which facilitates the determination of all the relevant contributions, an observation that may become useful for high-precision calculations. Using the above case as a guidance, we construct under some conditions an effective field theory for QCD states formed by a color-octet heavy quark-antiquark pair bound with a color-octet light-quark pair or excited gluonic state, highlighting the similarities and differences between the QED and QCD systems. Assuming that the multipole expansion is applicable, we construct the heavy-quark potential up to next-to-leading order in the multipole expansion in terms of nonperturbative matching coefficients to be obtained from lattice QCD.

  2. Efficient Maintenance and Update of Nonbonded Lists in Macromolecular Simulations.

    PubMed

    Chowdhury, Rezaul; Beglov, Dmitri; Moghadasi, Mohammad; Paschalidis, Ioannis Ch; Vakili, Pirooz; Vajda, Sandor; Bajaj, Chandrajit; Kozakov, Dima

    2014-10-14

    Molecular mechanics and dynamics simulations use distance based cutoff approximations for faster computation of pairwise van der Waals and electrostatic energy terms. These approximations traditionally use a precalculated and periodically updated list of interacting atom pairs, known as the "nonbonded neighborhood lists" or nblists, in order to reduce the overhead of finding atom pairs that are within distance cutoff. The size of nblists grows linearly with the number of atoms in the system and superlinearly with the distance cutoff, and as a result, they require significant amount of memory for large molecular systems. The high space usage leads to poor cache performance, which slows computation for large distance cutoffs. Also, the high cost of updates means that one cannot afford to keep the data structure always synchronized with the configuration of the molecules when efficiency is at stake. We propose a dynamic octree data structure for implicit maintenance of nblists using space linear in the number of atoms but independent of the distance cutoff. The list can be updated very efficiently as the coordinates of atoms change during the simulation. Unlike explicit nblists, a single octree works for all distance cutoffs. In addition, octree is a cache-friendly data structure, and hence, it is less prone to cache miss slowdowns on modern memory hierarchies than nblists. Octrees use almost 2 orders of magnitude less memory, which is crucial for simulation of large systems, and while they are comparable in performance to nblists when the distance cutoff is small, they outperform nblists for larger systems and large cutoffs. Our tests show that octree implementation is approximately 1.5 times faster in practical use case scenarios as compared to nblists.

  3. Minimal-Approximation-Based Distributed Consensus Tracking of a Class of Uncertain Nonlinear Multiagent Systems With Unknown Control Directions.

    PubMed

    Choi, Yun Ho; Yoo, Sung Jin

    2017-03-28

    A minimal-approximation-based distributed adaptive consensus tracking approach is presented for strict-feedback multiagent systems with unknown heterogeneous nonlinearities and control directions under a directed network. Existing approximation-based consensus results for uncertain nonlinear multiagent systems in lower-triangular form have used multiple function approximators in each local controller to approximate unmatched nonlinearities of each follower. Thus, as the follower's order increases, the number of the approximators used in its local controller increases. However, the proposed approach employs only one function approximator to construct the local controller of each follower regardless of the order of the follower. The recursive design methodology using a new error transformation is derived for the proposed minimal-approximation-based design. Furthermore, a bounding lemma on parameters of Nussbaum functions is presented to handle the unknown control direction problem in the minimal-approximation-based distributed consensus tracking framework and the stability of the overall closed-loop system is rigorously analyzed in the Lyapunov sense.

  4. Approximations first: a closer look at applications of the definite integral

    NASA Astrophysics Data System (ADS)

    Brandt, Keith

    2017-01-01

    I propose that students pay more attention to the approximations that lead to integral formulas when they study applications of the definite integral. The goal is to focus students on the underlying concepts and the definition of the definite integral - and to steer them away from memorizing formulas. To address this goal, I have written some computer-based activities that guide students through the nuts and bolts of the approximations that eventually lead to integral formulas. I describe the activities and suggest a few changes as to how we might approach this material.

  5. Fluctuations in microwave background radiation due to secondary ionization of the intergalactic gas in the universe

    NASA Technical Reports Server (NTRS)

    Sunyayev, R. A.

    1979-01-01

    Secondary heating and ionization of the intergalactic gas at redshifts z approximately 10-30 could lead to the large optical depth of the Universe for Thomson scattering and could smooth the primordial fluctuations formed at z approximately 1500. It is shown that the gas motions connected with the large scale density perturbations at z approximately 10-15 must lead to the generation of secondary fluctuations of microwave background. The contribution of the rich clusters of galaxies and young galaxies to the fluctuations of microwave background is also estimated.

  6. Consumption of lead-shot cervid meat and blood lead concentrations in a group of adult Norwegians.

    PubMed

    Meltzer, H M; Dahl, H; Brantsæter, A L; Birgisdottir, B E; Knutsen, H K; Bernhoft, A; Oftedal, B; Lande, U S; Alexander, J; Haugen, M; Ydersbond, T A

    2013-11-01

    Several recent investigations have reported high concentrations of lead in samples of minced cervid meat. This paper describes findings from a Norwegian study performed in 2012 among 147 adults with a wide range of cervid game consumption. The main aim was to assess whether high consumption of lead-shot cervid meat is associated with increased concentration of lead in blood. A second aim was to investigate to what extent factors apart from game consumption explain observed variability in blood lead levels. Median (5 and 95 percentile) blood concentration of lead was 16.6 µg/L (7.5 and 39 µg/L). An optimal multivariate linear regression model for log-transformed blood lead indicated that cervid game meat consumption once a month or more was associated with approximately 31% increase in blood lead concentrations. The increase seemed to be mostly associated with consumption of minced cervid meat, particularly purchased minced meat. However, many participants with high and long-lasting game meat intake had low blood lead concentrations. Cervid meat together with number of bullet shots per year, years with game consumption, self-assembly of bullets, wine consumption and smoking jointly accounted for approximately 25% of the variation in blood lead concentrations, while age and sex accounted for 27% of the variance. Blood lead concentrations increased approximately 18% per decade of age, and men had on average 30% higher blood lead concentrations than women. Hunters who assembled their own ammunition had 52% higher blood lead concentrations than persons not making ammunition. In conjunction with minced cervid meat, wine intake was significantly associated with increased blood lead. Our results indicate that hunting practices such as use of lead-based ammunition, self-assembling of lead containing bullets and inclusion of lead-contaminated meat for mincing to a large extent determine the exposure to lead from cervid game consumption. © 2013 Elsevier Inc. All rights reserved.

  7. Phase transitions in cooperative coinfections: Simulation results for networks and lattices

    NASA Astrophysics Data System (ADS)

    Grassberger, Peter; Chen, Li; Ghanbarnejad, Fakhteh; Cai, Weiran

    2016-04-01

    We study the spreading of two mutually cooperative diseases on different network topologies, and with two microscopic realizations, both of which are stochastic versions of a susceptible-infected-removed type model studied by us recently in mean field approximation. There it had been found that cooperativity can lead to first order transitions from spreading to extinction. However, due to the rapid mixing implied by the mean field assumption, first order transitions required nonzero initial densities of sick individuals. For the stochastic model studied here the results depend strongly on the underlying network. First order transitions are found when there are few short but many long loops: (i) No first order transitions exist on trees and on 2-d lattices with local contacts. (ii) They do exist on Erdős-Rényi (ER) networks, on d -dimensional lattices with d ≥4 , and on 2-d lattices with sufficiently long-ranged contacts. (iii) On 3-d lattices with local contacts the results depend on the microscopic details of the implementation. (iv) While single infected seeds can always lead to infinite epidemics on regular lattices, on ER networks one sometimes needs finite initial densities of infected nodes. (v) In all cases the first order transitions are actually "hybrid"; i.e., they display also power law scaling usually associated with second order transitions. On regular lattices, our model can also be interpreted as the growth of an interface due to cooperative attachment of two species of particles. Critically pinned interfaces in this model seem to be in different universality classes than standard critically pinned interfaces in models with forbidden overhangs. Finally, the detailed results mentioned above hold only when both diseases propagate along the same network of links. If they use different links, results can be rather different in detail, but are similar overall.

  8. Absolute phase estimation: adaptive local denoising and global unwrapping.

    PubMed

    Bioucas-Dias, Jose; Katkovnik, Vladimir; Astola, Jaakko; Egiazarian, Karen

    2008-10-10

    The paper attacks absolute phase estimation with a two-step approach: the first step applies an adaptive local denoising scheme to the modulo-2 pi noisy phase; the second step applies a robust phase unwrapping algorithm to the denoised modulo-2 pi phase obtained in the first step. The adaptive local modulo-2 pi phase denoising is a new algorithm based on local polynomial approximations. The zero-order and the first-order approximations of the phase are calculated in sliding windows of varying size. The zero-order approximation is used for pointwise adaptive window size selection, whereas the first-order approximation is used to filter the phase in the obtained windows. For phase unwrapping, we apply the recently introduced robust (in the sense of discontinuity preserving) PUMA unwrapping algorithm [IEEE Trans. Image Process.16, 698 (2007)] to the denoised wrapped phase. Simulations give evidence that the proposed algorithm yields state-of-the-art performance, enabling strong noise attenuation while preserving image details. (c) 2008 Optical Society of America

  9. The blind leading the blind: Mutual refinement of approximate theories

    NASA Technical Reports Server (NTRS)

    Kedar, Smadar T.; Bresina, John L.; Dent, C. Lisa

    1991-01-01

    The mutual refinement theory, a method for refining world models in a reactive system, is described. The method detects failures, explains their causes, and repairs the approximate models which cause the failures. The approach focuses on using one approximate model to refine another.

  10. The three-point function as a probe of models for large-scale structure

    NASA Technical Reports Server (NTRS)

    Frieman, Joshua A.; Gaztanaga, Enrique

    1993-01-01

    The consequences of models of structure formation for higher-order (n-point) galaxy correlation functions in the mildly non-linear regime are analyzed. Several variations of the standard Omega = 1 cold dark matter model with scale-invariant primordial perturbations were recently introduced to obtain more power on large scales, R(sub p) is approximately 20 h(sup -1) Mpc, e.g., low-matter-density (non-zero cosmological constant) models, 'tilted' primordial spectra, and scenarios with a mixture of cold and hot dark matter. They also include models with an effective scale-dependent bias, such as the cooperative galaxy formation scenario of Bower, etal. It is shown that higher-order (n-point) galaxy correlation functions can provide a useful test of such models and can discriminate between models with true large-scale power in the density field and those where the galaxy power arises from scale-dependent bias: a bias with rapid scale-dependence leads to a dramatic decrease of the hierarchical amplitudes Q(sub J) at large scales, r is approximately greater than R(sub p). Current observational constraints on the three-point amplitudes Q(sub 3) and S(sub 3) can place limits on the bias parameter(s) and appear to disfavor, but not yet rule out, the hypothesis that scale-dependent bias is responsible for the extra power observed on large scales.

  11. Gaussian closure technique applied to the hysteretic Bouc model with non-zero mean white noise excitation

    NASA Astrophysics Data System (ADS)

    Waubke, Holger; Kasess, Christian H.

    2016-11-01

    Devices that emit structure-borne sound are commonly decoupled by elastic components to shield the environment from acoustical noise and vibrations. The elastic elements often have a hysteretic behavior that is typically neglected. In order to take hysteretic behavior into account, Bouc developed a differential equation for such materials, especially joints made of rubber or equipped with dampers. In this work, the Bouc model is solved by means of the Gaussian closure technique based on the Kolmogorov equation. Kolmogorov developed a method to derive probability density functions for arbitrary explicit first-order vector differential equations under white noise excitation using a partial differential equation of a multivariate conditional probability distribution. Up to now no analytical solution of the Kolmogorov equation in conjunction with the Bouc model exists. Therefore a wide range of approximate solutions, especially the statistical linearization, were developed. Using the Gaussian closure technique that is an approximation to the Kolmogorov equation assuming a multivariate Gaussian distribution an analytic solution is derived in this paper for the Bouc model. For the stationary case the two methods yield equivalent results, however, in contrast to statistical linearization the presented solution allows to calculate the transient behavior explicitly. Further, stationary case leads to an implicit set of equations that can be solved iteratively with a small number of iterations and without instabilities for specific parameter sets.

  12. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Versino, Daniele; Bronkhorst, Curt Allan

    The computational formulation of a micro-mechanical material model for the dynamic failure of ductile metals is presented in this paper. The statistical nature of porosity initiation is accounted for by introducing an arbitrary probability density function which describes the pores nucleation pressures. Each micropore within the representative volume element is modeled as a thick spherical shell made of plastically incompressible material. The treatment of porosity by a distribution of thick-walled spheres also allows for the inclusion of micro-inertia effects under conditions of shock and dynamic loading. The second order ordinary differential equation governing the microscopic porosity evolution is solved withmore » a robust implicit procedure. A new Chebyshev collocation method is employed to approximate the porosity distribution and remapping is used to optimize memory usage. The adaptive approximation of the porosity distribution leads to a reduction of computational time and memory usage of up to two orders of magnitude. Moreover, the proposed model affords consistent performance: changing the nucleation pressure probability density function and/or the applied strain rate does not reduce accuracy or computational efficiency of the material model. The numerical performance of the model and algorithms presented is tested against three problems for high density tantalum: single void, one-dimensional uniaxial strain, and two-dimensional plate impact. Here, the results using the integration and algorithmic advances suggest a significant improvement in computational efficiency and accuracy over previous treatments for dynamic loading conditions.« less

  13. Orbitally invariant internally contracted multireference unitary coupled cluster theory and its perturbative approximation: theory and test calculations of second order approximation.

    PubMed

    Chen, Zhenhua; Hoffmann, Mark R

    2012-07-07

    A unitary wave operator, exp (G), G(+) = -G, is considered to transform a multiconfigurational reference wave function Φ to the potentially exact, within basis set limit, wave function Ψ = exp (G)Φ. To obtain a useful approximation, the Hausdorff expansion of the similarity transformed effective Hamiltonian, exp (-G)Hexp (G), is truncated at second order and the excitation manifold is limited; an additional separate perturbation approximation can also be made. In the perturbation approximation, which we refer to as multireference unitary second-order perturbation theory (MRUPT2), the Hamiltonian operator in the highest order commutator is approximated by a Mo̸ller-Plesset-type one-body zero-order Hamiltonian. If a complete active space self-consistent field wave function is used as reference, then the energy is invariant under orbital rotations within the inactive, active, and virtual orbital subspaces for both the second-order unitary coupled cluster method and its perturbative approximation. Furthermore, the redundancies of the excitation operators are addressed in a novel way, which is potentially more efficient compared to the usual full diagonalization of the metric of the excited configurations. Despite the loss of rigorous size-extensivity possibly due to the use of a variational approach rather than a projective one in the solution of the amplitudes, test calculations show that the size-extensivity errors are very small. Compared to other internally contracted multireference perturbation theories, MRUPT2 only needs reduced density matrices up to three-body even with a non-complete active space reference wave function when two-body excitations within the active orbital subspace are involved in the wave operator, exp (G). Both the coupled cluster and perturbation theory variants are amenable to large, incomplete model spaces. Applications to some widely studied model systems that can be problematic because of geometry dependent quasidegeneracy, H4, P4, and BeH(2), are performed in order to test the new methods on problems where full configuration interaction results are available.

  14. Lead Poisoning: A Need for Education.

    ERIC Educational Resources Information Center

    Lipnickey, Susan Cross

    1981-01-01

    Each year approximately 200 children die of lead poisoning. Especially vulnerable to the toxic effects of lead poisoning are the nervous system, kidneys, and the bones. Physiological effects of lead on the school-age child, screening processes, and roles of school personnel in dealing with suspected victims of lead poisoning are discussed. (JN)

  15. On Formulations of Discontinuous Galerkin and Related Methods for Conservation Laws

    NASA Technical Reports Server (NTRS)

    Huynh, H. T.

    2014-01-01

    A formulation for the discontinuous Galerkin (DG) method that leads to solutions using the differential form of the equation (as opposed to the standard integral form) is presented. The formulation includes (a) a derivative calculation that involves only data within each cell with no data interaction among cells, and (b) for each cell, corrections to this derivative that deal with the jumps in fluxes at the cell boundaries and allow data across cells to interact. The derivative with no interaction is obtained by a projection, but for nodal-type methods, evaluating this derivative by interpolation at the nodal points is more economical. The corrections are derived using the approximate (Dirac) delta functions. The formulation results in a family of schemes: different approximate delta functions give rise to different methods. It is shown that the current formulation is essentially equivalent to the flux reconstruction (FR) formulation. Due to the use of approximate delta functions, an energy stability proof simpler than that of Vincent, Castonguay, and Jameson (2011) for a family of schemes is derived. Accuracy and stability of resulting schemes are discussed via Fourier analyses. Similar to FR, the current formulation provides a unifying framework for high-order methods by recovering the DG, spectral difference (SD), and spectral volume (SV) schemes. It also yields stable, accurate, and economical methods.

  16. Approximate series solution of multi-dimensional, time fractional-order (heat-like) diffusion equations using FRDTM.

    PubMed

    Singh, Brajesh K; Srivastava, Vineet K

    2015-04-01

    The main goal of this paper is to present a new approximate series solution of the multi-dimensional (heat-like) diffusion equation with time-fractional derivative in Caputo form using a semi-analytical approach: fractional-order reduced differential transform method (FRDTM). The efficiency of FRDTM is confirmed by considering four test problems of the multi-dimensional time fractional-order diffusion equation. FRDTM is a very efficient, effective and powerful mathematical tool which provides exact or very close approximate solutions for a wide range of real-world problems arising in engineering and natural sciences, modelled in terms of differential equations.

  17. Approximate series solution of multi-dimensional, time fractional-order (heat-like) diffusion equations using FRDTM

    PubMed Central

    Singh, Brajesh K.; Srivastava, Vineet K.

    2015-01-01

    The main goal of this paper is to present a new approximate series solution of the multi-dimensional (heat-like) diffusion equation with time-fractional derivative in Caputo form using a semi-analytical approach: fractional-order reduced differential transform method (FRDTM). The efficiency of FRDTM is confirmed by considering four test problems of the multi-dimensional time fractional-order diffusion equation. FRDTM is a very efficient, effective and powerful mathematical tool which provides exact or very close approximate solutions for a wide range of real-world problems arising in engineering and natural sciences, modelled in terms of differential equations. PMID:26064639

  18. Smart Capsules for Lead Removal from Industrial Wastewater.

    PubMed

    Tylkowski, Bartosz; Jastrząb, Renata

    2017-04-10

    Ground and especially drinking water could be contaminated by heavy metal ions such as lead and chromium, or the metalloid arsenic, discarded from industrial wastewater. These heavy metal ions are regarded as highly toxic pollutants which could cause a wide range of health problems in case of a long-term accumulation in the body. Thus, there have been many efforts to reduce the concentration of lead ions in effluent wastewater. They have included the establishment of stringent permissible discharge levels and management policies, the application of various pollution-control technologies, and the development of adsorbent materials for lead reduction. According to Science [1] encapsulation, developed approximately 65 years ago, has been defined as a major interdisciplinary research technology. Encapsulation has been used to deliver almost everything from advanced drugs to unique consumer sensory experiences. In this chapter we review the art of encapsulation technology as a potential breakthrough solution for a recyclable removal system for lead ions. Moreover, in order to provide the readers with a comprehensive and in-depth understanding of recent developments and innovative applications in this field, we highlight some remarkable advantages of encapsulation for heavy metal remove, such as simplicity of preparation, applicability for a wide range of selective extractants, large special interfacial area, ability for concentration of metal ions from dilute solutions, and less leakage of harmful components to the environment.

  19. Primordial spectra of slow-roll inflation at second-order with the Gauss-Bonnet correction

    NASA Astrophysics Data System (ADS)

    Wu, Qiang; Zhu, Tao; Wang, Anzhong

    2018-05-01

    The slow-roll inflation for a single scalar field that couples to the Gauss-Bonnet (GB) term represents an important higher-order curvature correction inspired by string theory. With the arrival of the era of precision cosmology, it is expected that the high-order corrections become more and more important. In this paper we study the observational predictions of the slow-roll inflation with the GB term by using the third-order uniform asymptotic approximation method. We calculate explicitly the primordial power spectra, spectral indices, running of the spectral indices for both scalar and tensor perturbations, and the ratio between tensor and scalar spectra. These expressions are all written in terms of the Hubble and GB coupling flow parameters and expanded up to the next-to-leading order in the slow-roll expansions so they represent the most accurate results obtained so far in the literature. In addition, by studying the theoretical predictions of the scalar spectral index and the tensor-to-scalar ratio with the Planck 2015 constraints in a model with power-law potential and GB coupling, we show that the second-order corrections are important in the future measurements. We expect that the understanding of the GB corrections in the primordial spectra and their constraints by forthcoming observational data will provide clues for the UV complete theory of quantum gravity, such as the string/M-theory.

  20. Approximation methods for stochastic petri nets

    NASA Technical Reports Server (NTRS)

    Jungnitz, Hauke Joerg

    1992-01-01

    Stochastic Marked Graphs are a concurrent decision free formalism provided with a powerful synchronization mechanism generalizing conventional Fork Join Queueing Networks. In some particular cases the analysis of the throughput can be done analytically. Otherwise the analysis suffers from the classical state explosion problem. Embedded in the divide and conquer paradigm, approximation techniques are introduced for the analysis of stochastic marked graphs and Macroplace/Macrotransition-nets (MPMT-nets), a new subclass introduced herein. MPMT-nets are a subclass of Petri nets that allow limited choice, concurrency and sharing of resources. The modeling power of MPMT is much larger than that of marked graphs, e.g., MPMT-nets can model manufacturing flow lines with unreliable machines and dataflow graphs where choice and synchronization occur. The basic idea leads to the notion of a cut to split the original net system into two subnets. The cuts lead to two aggregated net systems where one of the subnets is reduced to a single transition. A further reduction leads to a basic skeleton. The generalization of the idea leads to multiple cuts, where single cuts can be applied recursively leading to a hierarchical decomposition. Based on the decomposition, a response time approximation technique for the performance analysis is introduced. Also, delay equivalence, which has previously been introduced in the context of marked graphs by Woodside et al., Marie's method and flow equivalent aggregation are applied to the aggregated net systems. The experimental results show that response time approximation converges quickly and shows reasonable accuracy in most cases. The convergence of Marie's method and flow equivalent aggregation are applied to the aggregated net systems. The experimental results show that response time approximation converges quickly and shows reasonable accuracy in most cases. The convergence of Marie's is slower, but the accuracy is generally better. Delay equivalence often fails to converge, while flow equivalent aggregation can lead to potentially bad results if a strong dependence of the mean completion time on the interarrival process exists.

  1. A Second-Order Phase Transition as a Limit of the First-Order Phase Transitions —Coherent Anomalies and Critical Phenomena in the Potts Models—

    NASA Astrophysics Data System (ADS)

    Katori, Makoto

    1988-12-01

    A new scheme of the coherent-anomaly method (CAM) is proposed to study critical phenomena in the models for which a mean-field description gives spurious first-order phase transition. A canonical series of mean-field-type approximations are constructed so that the spurious discontinuity should vanish asymptotically as the approximate critical temperature approachs the true value. The true value of the critical exponents β and γ are related to the coherent-anomaly exponents defined among the classical approximations. The formulation is demonstrated in the two-dimensional q-state Potts models for q{=}3 and 4. The result shows that the present method enables us to estimate the critical exponents with high accuracy by using the date of the cluster-mean-field approximations.

  2. Quirks of Stirling's Approximation

    ERIC Educational Resources Information Center

    Macrae, Roderick M.; Allgeier, Benjamin M.

    2013-01-01

    Stirling's approximation to ln "n"! is typically introduced to physical chemistry students as a step in the derivation of the statistical expression for the entropy. However, naive application of this approximation leads to incorrect conclusions. In this article, the problem is first illustrated using a familiar "toy…

  3. ACCESS 3. Approximation concepts code for efficient structural synthesis: User's guide

    NASA Technical Reports Server (NTRS)

    Fleury, C.; Schmit, L. A., Jr.

    1980-01-01

    A user's guide is presented for ACCESS-3, a research oriented program which combines dual methods and a collection of approximation concepts to achieve excellent efficiency in structural synthesis. The finite element method is used for structural analysis and dual algorithms of mathematical programming are applied in the design optimization procedure. This program retains all of the ACCESS-2 capabilities and the data preparation formats are fully compatible. Four distinct optimizer options were added: interior point penalty function method (NEWSUMT); second order primal projection method (PRIMAL2); second order Newton-type dual method (DUAL2); and first order gradient projection-type dual method (DUAL1). A pure discrete and mixed continuous-discrete design variable capability, and zero order approximation of the stress constraints are also included.

  4. Fabrication of Ordered Blue Nanostructure by Anodization of an Aluminum Plate

    NASA Astrophysics Data System (ADS)

    Kurashima, Yuichi; Yokota, Yoshihiko; Miyamoto, Iwao; Itatani, Taro

    2007-03-01

    Colors in organisms are created by chemical interactions of molecular pigments and by optical interactions of incident light with biological nanostructures. The latter classes are called structural colors and form an important component of the phenotypes of many animals and even some plants. In this paper, we report on the fabrication of an ordered blue nanostructure by the anodization of an Al plate. In the fabrication of such an ordered nanostructure by the anodization of an Al plate, ordered nanostructures with a pitch and an alumina thickness of approximately 100 nm were produced on the Al plate. The ordered nanostructures on the Al plate showed no colors. However, an ordered nanostructure deposited with a Pt thin film with a thickness of approximately 10 nm showed a blue reflection with a peak reflectivity of approximately 370 nm. We conclude that this blue nanostructure on the Al plate is caused by an interference between the Al surface and the Pt surface.

  5. Topographical scattering of gravity waves

    NASA Astrophysics Data System (ADS)

    Miles, J. W.; Chamberlain, P. G.

    1998-04-01

    A systematic hierarchy of partial differential equations for linear gravity waves in water of variable depth is developed through the expansion of the average Lagrangian in powers of [mid R:][nabla del, Hamilton operator][mid R:] (h=depth, [nabla del, Hamilton operator]h=slope). The first and second members of this hierarchy, the Helmholtz and conventional mild-slope equations, are second order. The third member is fourth order but may be approximated by Chamberlain & Porter's (1995) ‘modified mild-slope’ equation, which is second order and comprises terms in [nabla del, Hamilton operator]2h and ([nabla del, Hamilton operator]h)2 that are absent from the mild-slope equation. Approximate solutions of the mild-slope and modified mild-slope equations for topographical scattering are determined through an iterative sequence, starting from a geometrical-optics approximation (which neglects reflection), then a quasi-geometrical-optics approximation, and on to higher-order results. The resulting reflection coefficient for a ramp of uniform slope is compared with the results of numerical integrations of each of the mild-slope equation (Booij 1983), the modified mild-slope equation (Porter & Staziker 1995), and the full linear equations (Booij 1983). Also considered is a sequence of sinusoidal sandbars, for which Bragg resonance may yield rather strong reflection and for which the modified mild-slope approximation is in close agreement with Mei's (1985) asymptotic approximation.

  6. Energy conservation - A test for scattering approximations

    NASA Technical Reports Server (NTRS)

    Acquista, C.; Holland, A. C.

    1980-01-01

    The roles of the extinction theorem and energy conservation in obtaining the scattering and absorption cross sections for several light scattering approximations are explored. It is shown that the Rayleigh, Rayleigh-Gans, anomalous diffraction, geometrical optics, and Shifrin approximations all lead to reasonable values of the cross sections, while the modified Mie approximation does not. Further examination of the modified Mie approximation for the ensembles of nonspherical particles reveals additional problems with that method.

  7. Phases and approximations of baryonic popcorn in a low-dimensional analogue of holographic QCD

    NASA Astrophysics Data System (ADS)

    Elliot-Ripley, Matthew

    2015-07-01

    The Sakai-Sugimoto model is the most pre-eminent model of holographic QCD, in which baryons correspond to topological solitons in a five-dimensional bulk spacetime. Recently it has been shown that a single soliton in this model can be well approximated by a flat-space self-dual Yang-Mills instanton with a small size, although studies of multi-solitons and solitons at finite density are currently beyond numerical computations. A lower-dimensional analogue of the model has also been studied in which the Sakai-Sugimoto soliton is replaced by a baby Skyrmion in three spacetime dimensions with a warped metric. The lower dimensionality of this model means that full numerical field calculations are possible, and static multi-solitons and solitons at finite density were both investigated, in particular the baryonic popcorn phase transitions at high densities. Here we present and investigate an alternative lower-dimensional analogue of the Sakai-Sugimoto model in which the Sakai-Sugimoto soliton is replaced by an O(3)-sigma model instanton in a warped three-dimensional spacetime stabilized by a massive vector meson. A more detailed range of baryonic popcorn phase transitions are found, and the low-dimensional model is used as a testing ground to check the validity of common approximations made in the full five-dimensional model, namely approximating fields using their flat-space equations of motion, and performing a leading order expansion in the metric.

  8. Magnitude of pseudopotential localization errors in fixed node diffusion quantum Monte Carlo

    DOE PAGES

    Kent, Paul R.; Krogel, Jaron T.

    2017-06-22

    Growth in computational resources has lead to the application of real space diffusion quantum Monte Carlo to increasingly heavy elements. Although generally assumed to be small, we find that when using standard techniques, the pseudopotential localization error can be large, on the order of an electron volt for an isolated cerium atom. We formally show that the localization error can be reduced to zero with improvements to the Jastrow factor alone, and we define a metric of Jastrow sensitivity that may be useful in the design of pseudopotentials. We employ an extrapolation scheme to extract the bare fixed node energymore » and estimate the localization error in both the locality approximation and the T-moves schemes for the Ce atom in charge states 3+/4+. The locality approximation exhibits the lowest Jastrow sensitivity and generally smaller localization errors than T-moves although the locality approximation energy approaches the localization free limit from above/below for the 3+/4+ charge state. We find that energy minimized Jastrow factors including three-body electron-electron-ion terms are the most effective at reducing the localization error for both the locality approximation and T-moves for the case of the Ce atom. Less complex or variance minimized Jastrows are generally less effective. Finally, our results suggest that further improvements to Jastrow factors and trial wavefunction forms may be needed to reduce localization errors to chemical accuracy when medium core pseudopotentials are applied to heavy elements such as Ce.« less

  9. Using Stochastic Approximation Techniques to Efficiently Construct Confidence Intervals for Heritability.

    PubMed

    Schweiger, Regev; Fisher, Eyal; Rahmani, Elior; Shenhav, Liat; Rosset, Saharon; Halperin, Eran

    2018-06-22

    Estimation of heritability is an important task in genetics. The use of linear mixed models (LMMs) to determine narrow-sense single-nucleotide polymorphism (SNP)-heritability and related quantities has received much recent attention, due of its ability to account for variants with small effect sizes. Typically, heritability estimation under LMMs uses the restricted maximum likelihood (REML) approach. The common way to report the uncertainty in REML estimation uses standard errors (SEs), which rely on asymptotic properties. However, these assumptions are often violated because of the bounded parameter space, statistical dependencies, and limited sample size, leading to biased estimates and inflated or deflated confidence intervals (CIs). In addition, for larger data sets (e.g., tens of thousands of individuals), the construction of SEs itself may require considerable time, as it requires expensive matrix inversions and multiplications. Here, we present FIESTA (Fast confidence IntErvals using STochastic Approximation), a method for constructing accurate CIs. FIESTA is based on parametric bootstrap sampling, and, therefore, avoids unjustified assumptions on the distribution of the heritability estimator. FIESTA uses stochastic approximation techniques, which accelerate the construction of CIs by several orders of magnitude, compared with previous approaches as well as to the analytical approximation used by SEs. FIESTA builds accurate CIs rapidly, for example, requiring only several seconds for data sets of tens of thousands of individuals, making FIESTA a very fast solution to the problem of building accurate CIs for heritability for all data set sizes.

  10. Theoretical study of the design and performance of a high-gain, high-extraction-efficiency FEL oscillator

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Goldstein, J.; Nguyen, D.C.; Sheffield, R.L.

    1996-10-01

    We present the results of theoretical and simulation studies of the design and performance of a new F type of FEL oscillator. This device, known by the acronym RAFEL for Regenerative Amplifier Free-Electron Laser, will be constructed in the space presently occupied by the AFEL (Advanced FEL) at Los Alamos, and will be driven by an upgraded (to higher average power) version of the present AFEL linac. In order to achieve a long-time-averaged optical output power of {approximately} 1 kW using an electron beam with an average power of {approximately} 20 kW, a rather high extraction efficiency {eta} {approximately} 5%more » is required. We have designed a 2-m-long undulator to attain this goal: the first meter is untapered and provides high gain while the second meter is linearly-tapered in magnetic field amplitude to provide high extraction efficiency in the standard K-M-R manner. Two-plane focusing and linear polarization of the undulator are assumed. Electron-beam properties from PARMEIA simulations of the AFEL accelerator were used in the design. A large saturated gain, {approximately} 500, requires a very small optical feedback to keep the device operating at steady-state. However, the large gain leads to distorted optical modes which require two- and three-dimensional simulations to adequately treat diffraction effects. This FEL will be driven by 17 MeV electrons and will operate in the 16 {mu}m spectral region.« less

  11. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Kent, Paul R.; Krogel, Jaron T.

    Growth in computational resources has lead to the application of real space diffusion quantum Monte Carlo to increasingly heavy elements. Although generally assumed to be small, we find that when using standard techniques, the pseudopotential localization error can be large, on the order of an electron volt for an isolated cerium atom. We formally show that the localization error can be reduced to zero with improvements to the Jastrow factor alone, and we define a metric of Jastrow sensitivity that may be useful in the design of pseudopotentials. We employ an extrapolation scheme to extract the bare fixed node energymore » and estimate the localization error in both the locality approximation and the T-moves schemes for the Ce atom in charge states 3+/4+. The locality approximation exhibits the lowest Jastrow sensitivity and generally smaller localization errors than T-moves although the locality approximation energy approaches the localization free limit from above/below for the 3+/4+ charge state. We find that energy minimized Jastrow factors including three-body electron-electron-ion terms are the most effective at reducing the localization error for both the locality approximation and T-moves for the case of the Ce atom. Less complex or variance minimized Jastrows are generally less effective. Finally, our results suggest that further improvements to Jastrow factors and trial wavefunction forms may be needed to reduce localization errors to chemical accuracy when medium core pseudopotentials are applied to heavy elements such as Ce.« less

  12. Calculation of far wing of allowed spectra: The water continuum

    NASA Technical Reports Server (NTRS)

    Tipping, R. H.; Ma, Q.

    1995-01-01

    A far-wing line shape theory based on the binary collision and quasistatic approximations that is applicable for both the low- and high-frequency wings of allowed vibrational-rotational lines has been developed. This theory has been applied in order to calculate the frequency and temperature dependence of the continuous absorption coefficient for frequencies up to 10,000 cm(exp -1) for pure H2O and for H2O-N2 mixtures. The calculations are made assuming an interaction potential consisting of an isotropic Lennard-Jones part and the leading long-range anisotropic part, and utilizing the measured line strengths and transition frequencies. The results compare well with existing data, both in magnitude and in temperature dependence. This leads us to the conclusion that although dimer and collision-induced absorptions are present, the primary mechanism responsible for the observed water continuum is the far-wing absorption of allowed lines. Recent progress on near-wing corrections to the theory and validations with recent laboratory measurements are discussed briefly.

  13. Diffusion in random networks

    DOE PAGES

    Zhang, Duan Z.; Padrino, Juan C.

    2017-06-01

    The ensemble averaging technique is applied to model mass transport by diffusion in random networks. The system consists of an ensemble of random networks, where each network is made of pockets connected by tortuous channels. Inside a channel, fluid transport is assumed to be governed by the one-dimensional diffusion equation. Mass balance leads to an integro-differential equation for the pocket mass density. The so-called dual-porosity model is found to be equivalent to the leading order approximation of the integration kernel when the diffusion time scale inside the channels is small compared to the macroscopic time scale. As a test problem,more » we consider the one-dimensional mass diffusion in a semi-infinite domain. Because of the required time to establish the linear concentration profile inside a channel, for early times the similarity variable is xt $-$1/4 rather than xt $-$1/2 as in the traditional theory. We found this early time similarity can be explained by random walk theory through the network.« less

  14. Influence of the Numerical Scheme on the Solution Quality of the SWE for Tsunami Numerical Codes: The Tohoku-Oki, 2011Example.

    NASA Astrophysics Data System (ADS)

    Reis, C.; Clain, S.; Figueiredo, J.; Baptista, M. A.; Miranda, J. M. A.

    2015-12-01

    Numerical tools turn to be very important for scenario evaluations of hazardous phenomena such as tsunami. Nevertheless, the predictions highly depends on the numerical tool quality and the design of efficient numerical schemes still receives important attention to provide robust and accurate solutions. In this study we propose a comparative study between the efficiency of two volume finite numerical codes with second-order discretization implemented with different method to solve the non-conservative shallow water equations, the MUSCL (Monotonic Upstream-Centered Scheme for Conservation Laws) and the MOOD methods (Multi-dimensional Optimal Order Detection) which optimize the accuracy of the approximation in function of the solution local smoothness. The MUSCL is based on a priori criteria where the limiting procedure is performed before updated the solution to the next time-step leading to non-necessary accuracy reduction. On the contrary, the new MOOD technique uses a posteriori detectors to prevent the solution from oscillating in the vicinity of the discontinuities. Indeed, a candidate solution is computed and corrections are performed only for the cells where non-physical oscillations are detected. Using a simple one-dimensional analytical benchmark, 'Single wave on a sloping beach', we show that the classical 1D shallow-water system can be accurately solved with the finite volume method equipped with the MOOD technique and provide better approximation with sharper shock and less numerical diffusion. For the code validation, we also use the Tohoku-Oki 2011 tsunami and reproduce two DART records, demonstrating that the quality of the solution may deeply interfere with the scenario one can assess. This work is funded by the Portugal-France research agreement, through the research project GEONUM FCT-ANR/MAT-NAN/0122/2012.Numerical tools turn to be very important for scenario evaluations of hazardous phenomena such as tsunami. Nevertheless, the predictions highly depends on the numerical tool quality and the design of efficient numerical schemes still receives important attention to provide robust and accurate solutions. In this study we propose a comparative study between the efficiency of two volume finite numerical codes with second-order discretization implemented with different method to solve the non-conservative shallow water equations, the MUSCL (Monotonic Upstream-Centered Scheme for Conservation Laws) and the MOOD methods (Multi-dimensional Optimal Order Detection) which optimize the accuracy of the approximation in function of the solution local smoothness. The MUSCL is based on a priori criteria where the limiting procedure is performed before updated the solution to the next time-step leading to non-necessary accuracy reduction. On the contrary, the new MOOD technique uses a posteriori detectors to prevent the solution from oscillating in the vicinity of the discontinuities. Indeed, a candidate solution is computed and corrections are performed only for the cells where non-physical oscillations are detected. Using a simple one-dimensional analytical benchmark, 'Single wave on a sloping beach', we show that the classical 1D shallow-water system can be accurately solved with the finite volume method equipped with the MOOD technique and provide better approximation with sharper shock and less numerical diffusion. For the code validation, we also use the Tohoku-Oki 2011 tsunami and reproduce two DART records, demonstrating that the quality of the solution may deeply interfere with the scenario one can assess. This work is funded by the Portugal-France research agreement, through the research project GEONUM FCT-ANR/MAT-NAN/0122/2012.

  15. Connection between the regular approximation and the normalized elimination of the small component in relativistic quantum theory

    NASA Astrophysics Data System (ADS)

    Filatov, Michael; Cremer, Dieter

    2005-02-01

    The regular approximation to the normalized elimination of the small component (NESC) in the modified Dirac equation has been developed and presented in matrix form. The matrix form of the infinite-order regular approximation (IORA) expressions, obtained in [Filatov and Cremer, J. Chem. Phys. 118, 6741 (2003)] using the resolution of the identity, is the exact matrix representation and corresponds to the zeroth-order regular approximation to NESC (NESC-ZORA). Because IORA (=NESC-ZORA) is a variationally stable method, it was used as a suitable starting point for the development of the second-order regular approximation to NESC (NESC-SORA). As shown for hydrogenlike ions, NESC-SORA energies are closer to the exact Dirac energies than the energies from the fifth-order Douglas-Kroll approximation, which is much more computationally demanding than NESC-SORA. For the application of IORA (=NESC-ZORA) and NESC-SORA to many-electron systems, the number of the two-electron integrals that need to be evaluated (identical to the number of the two-electron integrals of a full Dirac-Hartree-Fock calculation) was drastically reduced by using the resolution of the identity technique. An approximation was derived, which requires only the two-electron integrals of a nonrelativistic calculation. The accuracy of this approach was demonstrated for heliumlike ions. The total energy based on the approximate integrals deviates from the energy calculated with the exact integrals by less than 5×10-9hartree units. NESC-ZORA and NESC-SORA can easily be implemented in any nonrelativistic quantum chemical program. Their application is comparable in cost with that of nonrelativistic methods. The methods can be run with density functional theory and any wave function method. NESC-SORA has the advantage that it does not imply a picture change.

  16. Periodic response of nonlinear systems

    NASA Technical Reports Server (NTRS)

    Nataraj, C.; Nelson, H. D.

    1988-01-01

    A procedure is developed to determine approximate periodic solutions of autonomous and non-autonomous systems. The trignometric collocation method (TCM) is formalized to allow for the analysis of relatively small order systems directly in physical coordinates. The TCM is extended to large order systems by utilizing modal analysis in a component mode synthesis strategy. The procedure was coded and verified by several check cases. Numerical results for two small order mechanical systems and one large order rotor dynamic system are presented. The method allows for the possibility of approximating periodic responses for large order forced and self-excited nonlinear systems.

  17. Approximation methods for control of acoustic/structure models with piezoceramic actuators

    NASA Technical Reports Server (NTRS)

    Banks, H. T.; Fang, W.; Silcox, R. J.; Smith, R. C.

    1991-01-01

    The active control of acoustic pressure in a 2-D cavity with a flexible boundary (a beam) is considered. Specifically, this control is implemented via piezoceramic patches on the beam which produces pure bending moments. The incorporation of the feedback control in this manner leads to a system with an unbounded input term. Approximation methods in this manner leads to a system with an unbounded input term. Approximation methods in the context of linear quadratic regulator (LQR) state space control formulation are discussed and numerical results demonstrating the effectiveness of this approach in computing feedback controls for noise reduction are presented.

  18. Closed-form eigensolutions of nonviscously, nonproportionally damped systems based on continuous damping sensitivity

    NASA Astrophysics Data System (ADS)

    Lázaro, Mario

    2018-01-01

    In this paper, nonviscous, nonproportional, vibrating structures are considered. Nonviscously damped systems are characterized by dissipative mechanisms which depend on the history of the response velocities via hereditary kernel functions. Solutions of the free motion equation lead to a nonlinear eigenvalue problem involving mass, stiffness and damping matrices. Viscoelasticity leads to a frequency dependence of this latter. In this work, a novel closed-form expression to estimate complex eigenvalues is derived. The key point is to consider the damping model as perturbed by a continuous fictitious parameter. Assuming then the eigensolutions as function of this parameter, the computation of the eigenvalues sensitivity leads to an ordinary differential equation, from whose solution arises the proposed analytical formula. The resulting expression explicitly depends on the viscoelasticity (frequency derivatives of the damping function), the nonproportionality (influence of the modal damping matrix off-diagonal terms). Eigenvectors are obtained using existing methods requiring only the corresponding eigenvalue. The method is validated using a numerical example which compares proposed with exact ones and with those determined from the linear first order approximation in terms of the damping matrix. Frequency response functions are also plotted showing that the proposed approach is valid even for moderately or highly damped systems.

  19. Isotopic evidence of spatial magnitude of the Pb deposition near a lead smelter

    NASA Astrophysics Data System (ADS)

    Flament, P.; Franssens, M.; Debout, K.; Weis, D.

    2003-05-01

    In order to détermine the dry deposition of lead around a Pb-Zn refinery, two cross-sectional sampling experiments, using deposition plates, have been performed on a daiiy basis, ucder representative meteorological situations (north-easterly and south-westerly winds). The amount of lead deposited as well as its isotopic composition (expressed by the ^{206}Pb/^{207}Pb ratio) are systematically measured. For a daily production of approximately 670 metric tons of (Pb+Zn) the dry fallout, greater than 1000 μg Pb.h^{-1}.m^{-2} on the edge of the plant, falls to about 100 μg Pb.h^{-1}.m^{-2}, four kilometres away from the refinery. This value is still ten times higher than th urban background (<10 μg Pb.h^{-1}.m^{-2}). The spatial extension of the dry deposition plume is evidenced by the evolution of the isotopic signature of the refinery (1.10<^{206}Pb/^{207}), clearly distinct from the urban backgrounde signature (1.15<^{206}Pb/^{207}Pb<1.16). As a first estimate, the extension of the deposition plume seems not to be linked to the wind speed. At the opposite, diffuse emissions from slag heaps are related to this parameter.

  20. Convergence of the strong-potential-Born approximation in Z/sub less-than//Z/sub greater-than/

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    McGuire, J.H.; Sil, N.C.

    1986-01-01

    Convergence of the strong-potential Born (SPB) approximation as a function of the charges of the projectile and target is studied numerically. Time-reversal invariance (or detailed balance) is satisfied at sufficiently high velocities even when the charges are asymmetric. This demonstarates that the SPB approximation converges to the correct result even when the charge of the ''weak'' potential, which is kept to first order, is larger than the charge of the ''strong'' potential, which is retained to all orders. Consequently, the SPB approximation is valid for systems of arbitrary charge symmetry (including symmetric systems) at sufficiently high velocities.

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