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  • American Institute of Physics (AIP)  (64)
  • 2000-2004  (64)
  • 2002  (64)
  • 1
    ISSN: 1089-7674
    Source: AIP Digital Archive
    Topics: Physics
    Notes: In optimized shear plasmas in the Joint European Torus [P. H. Rebut and B. E. Keen, Fusion Technol. 11, 13 (1987)], safety factor (q) profiles with negative magnetic shear are produced by applying lower hybrid (LH) waves during the plasma current ramp-up phase. These plasmas produce a barrier to the electron energy transport. The radius at which the barrier is located increases with the LH wave power. When heated with high power from ion cyclotron resonance heating and neutral beam injection, they can additionally produce transient internal transport barriers (ITBs) seen on the ion temperature, electron density, and toroidal rotation velocity profiles. Due to recent improvements in coupling, q profile control with LH current drive in ITB plasmas with strong combined heating can be explored. These new experiments have led to ITBs sustained for several seconds by the LH wave. Simulations show that the current driven by the LH waves peaks at the ITB location, indicating that it can act in the region of low magnetic shear. © 2002 American Institute of Physics.
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    Woodbury, NY : American Institute of Physics (AIP)
    Applied Physics Letters 80 (2002), S. 1076-1078 
    ISSN: 1077-3118
    Source: AIP Digital Archive
    Topics: Physics
    Notes: A modified ballistic electron emission microscopy (BEEM) technique using local transport of hot electrons through a buried interface, was successfully applied to study the Al2O3 barrier in the Co/Al2O3/Ru tunnel junction. This technique enabled us to straightforwardly measure an effective barrier height of 1.7 eV and to observe the rise of the barrier height due to continuous current injection into a single point of the junction attributed to charging effects and/or degradation of the barrier structure. Scanning over an area of 510 nm×510 nm showed a spatial inhomogenity of the barrier resulting in different dependencies of the BEEM current on the energy of the injected electrons. © 2002 American Institute of Physics.
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  • 3
    Electronic Resource
    Electronic Resource
    Woodbury, NY : American Institute of Physics (AIP)
    Applied Physics Letters 80 (2002), S. 625-627 
    ISSN: 1077-3118
    Source: AIP Digital Archive
    Topics: Physics
    Notes: A magnetic "spin filter" tunnel barrier, sandwiched between a nonmagnetic metal and a magnetic metal, is used to create a magnetoresistive tunnel device, somewhat analogous to an optical polarizer-analyzer configuration. The resistance of these trilayer structures depends on the relative magnetization orientation of the spin filter and the ferromagnetic electrode. The spin filtering in this configuration yields a previously unobserved magnetoresistance effect, exceeding 100%. © 2002 American Institute of Physics.
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  • 4
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 116 (2002), S. 3012-3017 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: In this article we describe a novel, phenomenologically based computer simulation approach for studying relaxation dynamics in fluid systems. The method utilizes an ensemble consisting of two isothermal chambers initially separated by an impermeable partition. The fluid configurations in each chamber are initially pre-equilibrated at densities ρ¯+cursive-epsilon and ρ¯−cursive-epsilon respectively, where ρ¯ reflects an average density of interest and cursive-epsilon a small perturbation about this value. After the pre-equilibration step the partition is removed and the entire ensemble allowed to relax towards an equilibrium state guided by a kinetic Monte Carlo computer simulation algorithm. Fickian transport coefficients are found from quantities calculated during this relaxation process. We present an analysis of the approach and illustrate its application to transport property calculations in purely diffusive lattice-gas systems. Our results focus upon the critical region for which there are few published results and where simulation results face the most challenges because of finite-size effects and the phenomenon known as critical slowing-down. © 2002 American Institute of Physics.
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  • 5
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 116 (2002), S. 3083-3089 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: We propose a self-consistent mean-field lattice-gas theory of intercalation compounds based on effective interactions between interstitials in the presence of the host atoms. In addition to short-range screened Coulomb repulsions, usually discussed in the lattice gas models, the present theory takes into account long-range effective attractions between intercalants due to elasticity of the host matrix. The mean-field phase diagram in the space of interaction parameters contains the domains of first- and second-order transitions of the order-disorder type, separated by a tricritical line, and the domain of the first-order transition of the gas–liquid-type separated from the homogeneous state by a critical line. Theoretical predictions are shown to be in qualitative agreement with the grand canonical Monte Carlo simulations. The peculiarities of the phase diagram give an insight into different types of behavior of the open circuit voltage observed in rechargeable batteries, in which an intercalation compound is used as an electrode material. © 2002 American Institute of Physics.
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  • 6
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 117 (2002), S. 2619-2628 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: The negative ion photoelectron spectra of the oxide anion complexes O−Rg, Rg=Ar, Kr, and Xe, and O−N2 have been recorded. In each spectrum, two partially resolved peaks were observed, their relative intensities varying with source conditions. These peaks were assigned to photodetachment transitions from the 2Σ ground state and unresolved 2Π3/2,1/2 low-lying excited states of the anion. From our data we find dissociation energies and bond lengths for the 2Σ and 2Π anion states. Periodic trends in the bond length and dissociation energy are examined and compared to those in the isoelectronic neutral halogen rare gas systems and the effect of anisotropy in the interatomic potential and relative interaction strength is examined. From our data we find that the dissociation energies in the anion system are much larger but that the 2Σ-2Π splitting is significantly lower. In addition to the diatomic clusters, we report the photoelectron spectra of the O−Krn=2–5 and O−Xen=2–3 clusters and tabulate the vertical detachment energies and peak widths. From a comparison of the energetics and peak broadening we are able to make a determination of the general structure of the n=2 and n=3 clusters. © 2002 American Institute of Physics.
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  • 7
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 116 (2002), S. 7893-7901 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: Highly excited states of gerade symmetry in molecular nitrogen have been investigated in a resonance-enhanced XUV+Vis (extreme ultraviolet+visible) transition scheme. Nineteen bands have been observed, of which only four involve known states [k 1Πg (v=1), x 1Σg− (v=2), and y 1Πg (v=1,2)], albeit in new systems. Three of the newly observed states have been assigned as y 1Πg (v=3) and k 1Πg (v=2,3). Level energies are determined with an accuracy of (approximate)0.20 cm−1. © 2002 American Institute of Physics.
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  • 8
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 116 (2002), S. 7752-7759 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: We present a fully parametrized bead–spring chain model for stained λ-phage DNA. The model accounts for the finite extensibility of the molecule, excluded volume effects, and fluctuating hydrodynamic interactions (HI). Parameters are determined from equilibrium experimental data for 21 μm stained λ-phage DNA, and are shown to quantitatively predict the non-equilibrium behavior of the molecule. The model is then used to predict the equilibrium and nonequilibrium behavior of DNA molecules up to 126 μm. In particular, the HI model gives results that are in quantitative agreement with experimental diffusivity data over a wide range of molecular weights. When the bead friction coefficient is fit to the experimental relaxation time at a particular molecular weight, the stretch in shear and extensional flows is adequately predicted by either a free-draining or HI model at that molecular weight, although the fitted bead friction coefficients for the two models differ significantly. In shear flow, we find two regimes at high shear rate (γ(overdot)) that follow different scaling behavior. In the first, the viscosity and first normal stress coefficient scale roughly as γ(overdot)−6/11 and γ(overdot)−14/11, respectively. At higher shear rates, these become γ(overdot)−2/3 and γ(overdot)−4/3. These regimes are found for both free-draining and HI models and can be understood based on scaling arguments for the diffusion of chain ends. © 2002 American Institute of Physics.
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  • 9
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 116 (2002), S. 7225-7230 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: A Monte Carlo algorithm that performs a random walk in energy space has been used to study random coil–helix and random coil–beta sheet transitions in model proteins. This method permits estimation of the density of states of a protein via a random walk on the energy surface, thereby allowing the system to escape from local free-energy minima with relative ease. A cubic lattice model and a knowledge based force field are employed for these simulations. It is shown that, for a given amino acid sequence, the method is able to fold long polypeptides reproducibly. Its results compare favorably with those of annealing and parallel tempering simulations, which have been used before in the same context. This method is used to examine the effect of amino acid sequence and chain length on the folding of several designer polypeptides. © 2002 American Institute of Physics.
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  • 10
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 117 (2002), S. 2503-2512 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: In our preceeding Paper I [Ref. 16] a method was developed to subtract the interactions due to periodically replicated charges (or other long-range entities) in one spatial dimension. The method constitutes a generalized "electrostatic layer correction" which adapts any standard three-dimensional summation method to slab-like conditions. Here the implementation of the layer correction is considered in detail for the standard Ewald (EW3DLC) and the P3M mesh Ewald (P3MLC) methods. In particular this method offers a strong control on the accuracy and an improved computational complexity of O(N log N) for mesh-based implementations. We derive anisotropic Ewald error formulas and give some fundamental guidelines for optimization. A demonstration of the accuracy, error formulas and computation times for typical systems is also presented.© 2002 American Institute of Physics.
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