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  • 1
    Publication Date: 2019-06-28
    Description: Potential curves for the higher-lying states of NO are used together with a general scattering code to compute accurate values of transport collision integrals for N(4S/0/)-O(3P) interactions. It is found that the major contribution to the collision integrals comes from these higher-lying states of NO. New values of the collision integrals for N(4S/0/)-N(4S/0/) and O(3P)-O(3P) interactions are computed as well. The tabulations of the collision integrals cover a broad range of temperatures from 250 to 100,000 K and can be used to determine transport properties such as viscosity, thermal conductivity, and the diffusion coefficient to the second order.
    Keywords: THERMODYNAMICS AND STATISTICAL PHYSICS
    Type: AIAA PAPER 88-2660
    Format: text
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  • 2
    Publication Date: 2019-06-28
    Description: A general computer code was developed to allow calculation of atom-atom and ion-atom transport collision integrals from accurate potential energy curves described by a set of discrete data points for a broad range of scattering conditions. This code is based upon semiclassical approximations that properly account for quantum mechanical behavior such as tunneling effects near a barrier maximum, resonance charge exchange, and nuclear symmetry effects. Transport collision integrals were determined for N-N, O-O, N(+)-N, and O(+)-O interactions from complete sets of accurate potential functions derived from combined experimental and ab initio structure calculations. For the O-O case, this includes results for excited states. The calculated values of the N(+)-N and O(+)-O resonance charge exchange cross section Q(ex) agree well with measurements from beam experiment that are available at high energies where the diffusion cross section Q(d) satisfies Q(d) approximately equal to 2Q(ex).
    Keywords: THERMODYNAMICS AND STATISTICAL PHYSICS
    Type: AIAA PAPER 87-1632
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  • 3
    Publication Date: 2019-07-12
    Description: Accurate collision integrals for the interactions of N(4S0) + N(4S0), O(3P) + O(3P), and N(4S0) + O(3P) are reported. These are computed from a semiclassical formulation of the scattering using the best available representations of all of the potential energy curves needed to describe the collisions. Spectroscopic curves and other accurate measured data are used where available; the results of accurate ab initio electronic structure calculations are used to determine the remaining potential curves. The high-lying states are found to give the largest contributions to the collision cross sections. The nine collision integrals needed to determine transport properties to second order are tabulated for translational temperatures in the range 250-100,000 K. The viscosity, thermal conductivity, diffusion coefficient, and thermal diffusion factor for a gas composed of nitrogen and oxygen atoms in thermal equilibrium have been calculated. It is found that the second-order contribution to the transport properties is small. Graphs of these transport properties for various mixture ratios are presented for temperatures in the range 5000-15,000 K.
    Keywords: THERMODYNAMICS AND STATISTICAL PHYSICS
    Type: Journal of Thermophysics and Heat Transfer (ISSN 0887-8722); 4; 469-477
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