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  • 1
    Electronic Resource
    Electronic Resource
    s.l. : American Chemical Society
    Analytical chemistry 65 (1993), S. 1491-1492 
    ISSN: 1520-6882
    Source: ACS Legacy Archives
    Topics: Chemistry and Pharmacology
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    s.l. : American Chemical Society
    The @journal of physical chemistry 〈Washington, DC〉 96 (1992), S. 2205-2210 
    Source: ACS Legacy Archives
    Topics: Chemistry and Pharmacology , Physics
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    [S.l.] : American Institute of Physics (AIP)
    Journal of Applied Physics 72 (1992), S. 1133-1136 
    ISSN: 1089-7550
    Source: AIP Digital Archive
    Topics: Physics
    Notes: We report for the first time, diamond growth from a mixture of 95% CO and 5% CH4 without gas phase hyperdilution of H2. Such a mixture has not been previously reported to yield diamond by any of the existing methods (hot-filament chemical vapor deposition, plasma-assisted chemical vapor deposition, or flame synthesis). In this paper we describe our observations of diamond growth at low pressures from vibrational excitation of CO in a CO/CH4 mixture by irradiation from a CO laser operating on its shorter wavelengths. We refer to this technique as laser excited chemical vapor deposition.
    Type of Medium: Electronic Resource
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  • 4
    Electronic Resource
    Electronic Resource
    [S.l.] : American Institute of Physics (AIP)
    Journal of Applied Physics 68 (1990), S. 851-855 
    ISSN: 1089-7550
    Source: AIP Digital Archive
    Topics: Physics
    Notes: Following an earlier study on the temperature dependence of the resistive component of the leakage current of a ZnO varistor, a detailed study has been undertaken in this paper to compare the temperature dependence of the resistive (IR), capacitive (IC), and total (IT) leakage currents between unannealed and 600 °C annealed samples. It is shown that, as before, an Arrhenius plot of IC and IR versus temperature can best be represented by a break in the plot comprising a high-temperature regime (125–165°C) with a high activation energy and a low-temperature regime (30–100 °C with a low activation energy. The activation energies of IR-T curves are generally higher than those of IC-T curves in both temperatures regimes. Upon annealing at the critical temperature of 600 °C, the activation energy changes for both current components, accompanied by increased stability of the varistor. For IR, the activation energy becomes higher in the low-temperature regime in agreement with previous observation, and for IC, it becomes lower in the higher-temperature regime. The relative contributions of these two current components on total current are also different in the two temperature regimes. In the low-temperature regime, the total current is mostly capacitive, and in the high-temperature regime, it is mostly resistive. The varistor is thus prone to more Joule heating in the high-temperature regime than in the low-temperature regime.
    Type of Medium: Electronic Resource
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  • 5
    Electronic Resource
    Electronic Resource
    [S.l.] : American Institute of Physics (AIP)
    Journal of Applied Physics 68 (1990), S. 845-850 
    ISSN: 1089-7550
    Source: AIP Digital Archive
    Topics: Physics
    Notes: The ZnO varistor is known to require a postsintering heat treatment (annealing) to impart stability to an otherwise unstable device, when subjected to an applied voltage stress. A large body of experimental data in the literature indicate that the most desirable temperature of annealing is between 600 and 700 °C at which the varistor becomes highly stable. This paper is aimed at understanding the significance of this annealing temperature from the analysis of the activation energies, estimated from the Arrhenius plots of the resistive current versus temperature in the prebreakdown region. It is found that the activation energy in the annealing temperature range of 600–700 °C is significantly higher than at any other annealing temperature between 500 and 800 °C. This conclusion is borne out by the statistical evaluation of the experimental data. When this result is combined with the equally notable observations in the literature that the interface state density [J. Mater. Sci. 20, 3487 (1985)], the grain-boundary trap density [J. Appl. Phys. 63, 5375 (1988)], and the density of the negatively charged zinc vacancy at the interface [J. Appl. Phys. 66, 6132 (1989)] are all reduced, also at the same annealing temperature range, it becomes clear that the annealing temperature of 600–700 °C is very unique to varistor stability. The significance of these observations is that the annealing and accompanying stability should be recognized as a very complex process that brings fundamental changes in the grain-boundary junction characteristic of the polycrystalline ceramic.
    Type of Medium: Electronic Resource
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  • 6
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 94 (1991), S. 6737-6739 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: In the classical time-dependent Hartree approximation (TDH), the dynamics of a single molecule is approximated by that of a "field'' (each field being N "copies'' of the molecule which are transparent to one another while interacting with the system via a scaled force). It is shown that when some molecules are represented by a field of copies, while other molecules are represented normally, the average kinetic energy of the system increases linearly with the number of copies and diverges in the limit of large N. Nevertheless, the TDH method with appropriate energy scaling can serve as a useful means of enhancing the configurational sampling for problems involving coupled systems with disparate numbers of degrees of freedom.
    Type of Medium: Electronic Resource
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  • 7
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 93 (1990), S. 6804-6812 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: Molecular dynamics simulations are used to determine the time-dependent friction for pair diffusion in an isotropic Lennard-Jones fluid as a function of the separation between two diffusing particles. A numerical method proposed by Straub, Borkovec and Berne is used. It is found that both the initial value and the detailed time-dependence of the friction are dependent on the interparticle separation. The dependence of the pair diffusion coefficient on separation is determined. Comparisons are made with various hydrodynamic and collision theories. The rate constant for diffusion controlled reactions is discussed.
    Type of Medium: Electronic Resource
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  • 8
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 93 (1990), S. 5084-5095 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: A wide variety of problems involving molecular motion in liquids can be formulated in terms of the generalized Langevin equation (GLE). The friction coefficient on a molecular bond or on some more complicated reaction coordinate is then required. An often used approximation is to set the dynamic friction constant equal to the autocorrelation function of the fluctuating force exerted on the frozen bond by the remaining unfrozen coordinates. The true friction involves projection operators and should differ from this approximation. In this paper we derive various identities and show that the rigid bond approximation is the high frequency limit of the true dynamic friction coefficient. We compute the "true'' dynamic friction and the friction approximated on the basis of the rigid or frozen bond and show that the asymptotic limit is very accurate even for frequencies not much larger than the peak frequency of the solvent spectral density. Two different dynamical systems are studied using MD simulations with our newly devised NAPA integrator for systems with disparate time scales. In one the molecule is not allowed to rotate and in the other it is allowed to rotate. Interestingly, even for very long rotational reorientation times, small but significant differences in the long time decay of the bond dynamic friction are observed for rotational and nonrotational molecules—differences, however, that do not produce large differences in the static friction constants.
    Type of Medium: Electronic Resource
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  • 9
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 99 (1993), S. 4024-4035 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: An approximate method for integrating the Liouville equation to obtain the time-dependent classical phase space density distribution at constant energy or temperature is presented. The density distribution of each degree of freedom is represented by a single Gaussian phase packet (GPP) whose center and width obey variationally optimized equations of motion. The constant energy dynamics is applied to the calculation of equilibrium thermodynamic averages for a Lennard-Jones cluster and fluid to demonstrate the feasibility and utility of this approximate method for the simulation of many-body condensed phase systems. The rate of kinetic energy equipartitioning is examined for GPP dynamics using a generalization of the ergodic measure and found to be significantly faster than for standard molecular dynamics simulation. A global optimization algorithm is developed based on simulated annealing of the phase space density distribution. This method is applied to the global energy minimization of Lennard-Jones clusters and found to be superior to simulated annealing methods employing classical point particles.
    Type of Medium: Electronic Resource
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  • 10
    Electronic Resource
    Electronic Resource
    [S.l.] : American Institute of Physics (AIP)
    Review of Scientific Instruments 65 (1994), S. 3279-3281 
    ISSN: 1089-7623
    Source: AIP Digital Archive
    Topics: Physics , Electrical Engineering, Measurement and Control Technology
    Notes: The useful range of a capacitance diaphragm gauge is extended down to 1×10−6 Torr with an uncertainty of ±10−7 Torr using computer-based averaging. Gauge linearity is measured by observing the deflection of the diaphragm by the force of gravity. Precise pressure increments are generated by tilting the gauge through a range of accurately measured angles. By this procedure the gauge is observed to be linear to within ±1% plus 10−7 Torr between 1×10−6 and 8×10−3 Torr. Additionally, the deflection of the center of the diaphragm per unit pressure is found to be 2×10−5 m Torr−1.
    Type of Medium: Electronic Resource
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