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  • 1
    Electronic Resource
    Electronic Resource
    Companion equations for branes (2000)
    College Park, Md. : American Institute of Physics (AIP)
    Journal of Mathematical Physics 41 (2000), S. 4284-4292 
    Details
    ISSN: 1089-7658
    Source: AIP Digital Archive
    Topics: Mathematics , Physics
    Notes: The quantum mechanical transition between a free particle Lagrangian and the Klein–Gordon field description of a free particle (particle-wave duality) is conjectured to extend to an analogous construction of relativistically invariant wave equations associated with strings and branes. Electromagnetic interactions in the two systems are discussed. It is emphasized that all integrable free field theories, including those of Dirac–Born–Infeld type, are associated with Lagrangians equivalent to divergences on the space of solutions of the equations of motion. © 2000 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.533342
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  • 2
    Electronic Resource
    Electronic Resource
    Assessment of the Handy–Cohen optimized exchange density functional for organic reactions (2002)
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 117 (2002), S. 1441-1449 
    Details
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: We have investigated the performance of the new optimized exchange functional (OPTX) developed by Handy and Cohen [Mol. Phys. 99, 403 (2001)] for predicting geometries, heats of reaction, and barrier heights for twelve organic reactions (six closed-shell and six radical). OPTX has been used in conjunction with, among others, the well-known Lee–Yang–Parr (LYP) correlational functional to form two new functionals, OLYP and O3LYP. These are similar to the well-established BLYP and B3LYP functionals, respectively, with OPTX replacing the standard Becke exchange functional, B88. Our results strongly support claims made by their developers that OLYP is superior to BLYP, and essentially renders it obsolete. The computed OLYP heats of reaction, barrier heights, and even molecular geometries (with larger basis sets), are comparable with, if not better than, the corresponding B3LYP values. The O3LYP functional is overall better than B3LYP, albeit not by much. Both OLYP and O3LYP are among the best functionals currently available; the performance of OLYP in particular is noteworthy given that this functional includes no exact exchange. © 2002 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.1485723
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  • 3
    Electronic Resource
    Electronic Resource
    Electric field induced instabilities at liquid/liquid interfaces (2001)
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 114 (2001), S. 2377-2381 
    Details
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: External electric fields were used to amplify thermal fluctuations at the interface between two thin liquid films. Similar to the results shown previously for the enhancement of fluctuations at the polymer/air interface, interfacial fluctuations having a well-defined wavelength were enhanced with a characteristic growth rate. A simple theoretical framework to describe the experimental observations is presented. Both experiment and model calculation show a substantial reduction in feature size as a result of the change in surface/interfacial energy when going from the thin film to the bilayer case. Experimentally, features develop nearly 50 times faster for the bilayers in comparison to the polymer/air case. These results point to a simple route by which the nanoscopic feature can be easily and rapidly produced or replicated. © 2001 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.1338125
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  • 4
    Electronic Resource
    Electronic Resource
    Geometry optimization of large biomolecules in redundant internal coordinates (2000)
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 113 (2000), S. 6566-6572 
    Details
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: We present an improved version of our recent algorithm [B. Paizs, G. Fogarasi, and P. Pulay, J. Chem. Phys. 109, 6571 (1998)] for optimizing the geometries of large molecules. The approximate Cholesky factorization technique has been generalized to the case of redundant coordinates, and an alternative approach involving use of the B†B matrix in the iterative coordinate back transformation is described. The generalized full Cholesky factors of B†B are very sparse and the corresponding force and geometry transformations are fast and numerically stable, permitting us to apply this technique for internal coordinate geometry optimization of molecules containing thousands of atoms. As an example we present optimization data on alpha-helical alanine polypeptides, and various globular proteins. Results for the alanine polypeptides indicates that internal coordinate optimization is clearly superior to the first-order Cartesian optimization techniques generally used in force field calculations. The largest system investigated is alpha-helical Ac-(Ala)999-NH2 containing 9999 atoms, which was successfully optimized using less than a megaword of memory. Optimization of various globular proteins shows that our procedure can easily deal with highly redundant (including full primitive) coordinate sets. © 2000 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.1308551
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  • 5
    Electronic Resource
    Electronic Resource
    Erratum: "Polarization around an ion in a dielectric continuum with truncated electrostatic interactions" [J. Chem. Phys. 110, 10679 (1999)] (2000)
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 113 (2000), S. 2510-2511 
    Details
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: An error was made in the derivation of Eq. (25) for the integrated electric field. The error is corrected and the modified results reported. In general, the various truncation schemes show improved agreement with the Born model for solvent polarization. © 2000 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.482073
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  • 6
    Electronic Resource
    Electronic Resource
    The "Compact Toroid Injection Experiment" tomographic imaging system (2000)
    [S.l.] : American Institute of Physics (AIP)
    Review of Scientific Instruments 71 (2000), S. 4119-4126 
    Details
    ISSN: 1089-7623
    Source: AIP Digital Archive
    Topics: Physics , Electrical Engineering, Measurement and Control Technology
    Notes: The design, construction and operation of a tomographic imaging system on the Compact Toroid Injection Experiment is described. The system measures the total radiated power over energies from visible light up into the extreme ultraviolet. It then reconstructs two dimensional profiles from the data. The reconstruction routine is based on a method known as second order regularization which finds a compromise between smoothness and fit to the data. This method was found to have the best overall fidelity to test images. The hardware and overall reconstruction were calibrated using two different sources. First results from the system under real experimental conditions are presented. © 2000 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.1318920
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  • 7
    Electronic Resource
    Electronic Resource
    The construction of a gas aggregation source for the preparation of size-selected nanoscale transition metal clusters (2000)
    [S.l.] : American Institute of Physics (AIP)
    Review of Scientific Instruments 71 (2000), S. 3178-3183 
    Details
    ISSN: 1089-7623
    Source: AIP Digital Archive
    Topics: Physics , Electrical Engineering, Measurement and Control Technology
    Notes: The design and operation of a gas aggregation source is described. The source combines the attributes of high-temperature operation (enabling preparation of transition metal clusters), mass selection, ultrahigh vacuum compatibility, and transportability. This makes it ideally suited to in situ studies such as scanning tunneling microscope or synchrotron radiation experiments. Data are presented to illustrate the performance of the source; recent results obtained in synchrotron radiation studies are highlighted. © 2000 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.1304868
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  • 8
    Electronic Resource
    Electronic Resource
    Decay of the daughter electromagnetic wave driven by stimulated Raman scattering into two Langmuir waves (2000)
    [S.l.] : American Institute of Physics (AIP)
    Physics of Plasmas 7 (2000), S. 2759-2762 
    Details
    ISSN: 1089-7674
    Source: AIP Digital Archive
    Topics: Physics
    Notes: Much attention has been focused on the saturation of stimulated Raman scattering by the decay of its daughter waves. This research has almost exclusively dealt with the decay of the daughter Langmuir wave into secondary Langmuir waves and ion acoustic waves. In this Letter, the decay of the Raman driven electromagnetic wave into two Langmuir waves, two-plasmon decay, is discussed for the first time. It is shown that based on the stimulated Raman scattering reflectivity levels measured in experiments, this instability should be present in current laser–plasma experiments. In addition, experimental signatures of this process are discussed. © 2000 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.874174
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  • 9
    Electronic Resource
    Electronic Resource
    Particle transport in DIII-D discharges with internal regions of enhanced confinement and counter injected neutral beams (2001)
    [S.l.] : American Institute of Physics (AIP)
    Physics of Plasmas 8 (2001), S. 1565-1572 
    Details
    ISSN: 1089-7674
    Source: AIP Digital Archive
    Topics: Physics
    Notes: An analysis of experimentally measured particle transport in tokamak plasmas with negative central magnetic shear is presented. The analysis is presented in terms of a simple model for turbulent transport which allows the separation of diagonal and off diagonal terms and allows the direct comparison of particle and energy transport. Comparing the measured fluxes to the fluxes predicted by a simple quasi analytical model which specifies a relation between the diagonal and off diagonal terms allows an understanding of the reason for the difference between energy and particle fluxes. In the center of discharges with a region of enhanced confinement (or internal transport barrier), the ion thermal diffusivity becomes small and comparable to neoclassical values and the particle diffusivity also becomes small and approaches the neoclassical values. © 2001 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.1358311
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  • 10
    Electronic Resource
    Electronic Resource
    Comparison of particle confinement in the high confinement mode plasmas with the edge localized mode of the Japan Atomic Energy Research Institute Tokamak-60 Upgrade and the DIII-D tokamak (2001)
    [S.l.] : American Institute of Physics (AIP)
    Physics of Plasmas 8 (2001), S. 1607-1611 
    Details
    ISSN: 1089-7674
    Source: AIP Digital Archive
    Topics: Physics
    Notes: Particle confinement was compared for the high confinement mode plasmas with the edge localized mode in the Japan Atomic Energy Research Institute Tokamak-60 Upgrade (JT-60U) [S. Ishida, JT-60 Team, Nucl. Fusion 39, 1211 (1999)] and the DIII-D tokamak [J. L. Luxon et al., Plasma Physics and Controlled Nuclear Fusion Research 1986 (International Atomic Energy Agency, Vienna, 1987), Vol. 1, p. 159] considering separate confinement times for particles supplied by neutral beam injection (NBI) (center fueling) and by recycling and gas-puffing (edge fueling). Similar dependence on the NBI power was obtained in JT-60U and DIII-D. The particle confinement time for center fueling in DIII-D was smaller by a factor of 4 in the low density discharges and by a factor of 1.8 in the high density discharges than JT-60U scaling, respectively, suggesting the stronger dependence on the density in DIII-D. The particle confinement time for edge fueling in DIII-D was comparable with JT-60U scaling in the low density discharges. However, it decreased to a much smaller value in the high density discharges. © 2001 American Institute of Physics.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.1362295
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