9,407 research outputs found

    AtomSim: web-deployed atomistic dynamics simulator

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    AtomSim, a collection of interfaces for computational crystallography simulations, has been developed. It uses forcefield-based dynamics through physics engines such as the General Utility Lattice Program, and can be integrated into larger computational frameworks such as the Virtual Neutron Facility for processing its dynamics into scattering functions, dynamical functions etc. It is also available as a Google App Engine-hosted web-deployed interface. Examples of a quartz molecular dynamics run and a hafnium dioxide phonon calculation are presented

    Mean Field Theory of the Morphology Transition in Stochastic Diffusion Limited Growth

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    We propose a mean-field model for describing the averaged properties of a class of stochastic diffusion-limited growth systems. We then show that this model exhibits a morphology transition from a dense-branching structure with a convex envelope to a dendritic one with an overall concave morphology. We have also constructed an order parameter which describes the transition quantitatively. The transition is shown to be continuous, which can be verified by noting the non-existence of any hysteresis.Comment: 16 pages, 5 figure

    Improved quantification of Chinese carbon fluxes using CO2/CO correlations in Asian outflow

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    [1] We use observed CO2:CO correlations in Asian outflow from the TRACE-P aircraft campaign (February–April 2001), together with a three-dimensional global chemical transport model (GEOS-CHEM), to constrain specific components of the east Asian CO2 budget including, in particular, Chinese emissions. The CO2/CO emission ratio varies with the source of CO2 (different combustion types versus the terrestrial biosphere) and provides a characteristic signature of source regions and source type. Observed CO2/CO correlation slopes in east Asian boundary layer outflow display distinct regional signatures ranging from 10–20 mol/mol (outflow from northeast China) to 80 mol/mol (over Japan). Model simulations using best a priori estimates of regional CO2 and CO sources from Streets et al. [2003] (anthropogenic), the CASA model (biospheric), and Duncan et al. [2003] (biomass burning) overestimate CO2 concentrations and CO2/CO slopes in the boundary layer outflow. Constraints from the CO2/CO slopes indicate that this must arise from an overestimate of the modeled regional net biospheric CO2 flux. Our corrected best estimate of the net biospheric source of CO2 from China for March–April 2001 is 3200 Gg C/d, which represents a 45 % reduction of the net flux from the CASA model. Previous analyses of the TRACE-P data had found that anthropogenic Chinese C

    The Weiss conjecture on admissibility of observation operators for contraction semigroups

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    We prove the conjecture of George Weiss for contraction semigroups on Hilbert spaces, giving a characterization of infinite-time admissible observation functionals for a contraction semigroup, namely that such a functional C is infinite-time admissible if and only if there is an M > 0 such that parallel to IC(sI - A)(-1)parallel to less than or equal to M/root Re s for all s in the open right half-plane. Here A denotes the infinitesimal generator of the semigroup. The result provides a simultaneous generalization of several celebrated results from the theory of Hardy spaces involving Carleson measures and Hankel operators

    Numerical Simulations of Plasma Based Flow Control Applications

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    A mathematical model was developed to simulate flow control applications using plasma actuators. The effects of the plasma actuators on the external flow are incorporated into Navier Stokes computations as a body force vector. In order to compute this body force vector, the model solves two additional equations: one for the electric field due to the applied AC voltage at the electrodes and the other for the charge density representing the ionized air. The model is calibrated against an experiment having plasma-driven flow in a quiescent environment and is then applied to simulate a low pressure turbine flow with large flow separation. The effects of the plasma actuator on control of flow separation are demonstrated numerically

    Charge Solitons in 1-D Arrays of Serially Coupled Josephson Junctions

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    We study a 1-D array of Josephson coupled superconducting grains with kinetic inductance which dominates over the Josephson inductance. In this limit the dynamics of excess Cooper pairs in the array is described in terms of charge solitons, created by polarization of the grains. We analyze the dynamics of these topological excitations, which are dual to the fluxons in a long Josephson junction, using the continuum sine-Gordon model. We find that their classical relativistic motion leads to saturation branches in the I-V characteristic of the array. We then discuss the semi-classical quantization of the charge soliton, and show that it is consistent with the large kinetic inductance of the array. We study the dynamics of a quantum charge soliton in a ring-shaped array biased by an external flux through its center. If the dephasing length of the quantum charge soliton is larger than the circumference of the array, quantum phenomena like persistent current and coherent current oscillations are expected. As the characteristic width of the charge soliton is of the order of 100 microns, it is a macroscopic quantum object. We discuss the dephasing mechanisms which can suppress the quantum behaviour of the charge soliton.Comment: 26 pages, LaTex, 7 Postscript figure

    Orthogonality Catastrophe in Parametric Random Matrices

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    We study the orthogonality catastrophe due to a parametric change of the single-particle (mean field) Hamiltonian of an ergodic system. The Hamiltonian is modeled by a suitable random matrix ensemble. We show that the overlap between the original and the parametrically modified many-body ground states, SS, taken as Slater determinants, decreases like n−kx2n^{-k x^2}, where nn is the number of electrons in the systems, kk is a numerical constant of the order of one, and xx is the deformation measured in units of the typical distance between anticrossings. We show that the statistical fluctuations of SS are largely due to properties of the levels near the Fermi energy.Comment: 12 pages, 8 figure
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