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  • 1
    Publication Date: 2011-08-17
    Description: The homogeneously broadened linewidth of OH due to collisions with water molecules was found to decrease with increasing rotational excitation, and tended to level off to a constant value. This observed dependence is a manifestation of the rotational distribution of the water molecule through rotational transitions in near resonance with those of the OH. The constant value at high rotational excitation reflects the nonresonant contributions to the homogeneous linewidth similar to those due to nonpolar molecules.
    Keywords: ATOMIC AND MOLECULAR PHYSICS
    Type: Physical Review A - General Physics; vol. 22
    Format: text
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  • 2
    Publication Date: 2019-06-27
    Description: Harrison's one-electron bond-orbital model of tetrahedrally coordinated solids was generalized to a two-electron model, using an extension of the method of Falicov and Harris for treating the hydrogen molecule. The six eigenvalues and eigenstates of the two-electron anion-cation Hamiltonian entering this theory can be found exactly general. The two-electron formalism is shown to provide a useful basis for calculating both non-magnetic and magnetic properties of semiconductors in perturbation theory. As an example of the former, expressions for the electric susceptibility and the dielectric constant were calculated. As an example of the latter, new expressions for the nuclear exchanges and pseudo-dipolar coefficients were calculated. A simple theoretical relationship between the dielectric constant and the exchange coefficient was also found in the limit of no correlation. These expressions were quantitatively evaluated in the limit of no correlation for twenty semiconductors.
    Keywords: ATOMIC AND MOLECULAR PHYSICS
    Type: NASA-TM-X-72889
    Format: application/pdf
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  • 3
    Publication Date: 2019-06-27
    Keywords: ATOMIC AND MOLECULAR PHYSICS
    Type: Journal of Chemical Physics; 65; Aug. 15
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  • 4
    Publication Date: 2019-06-27
    Description: The one-electron bond-orbital model of Harrison (1973) for tetrahedrally coordinated solids is modified to a two-electron model using a generalization of Falicov and Harris' (1969) method for treating the hydrogen molecule. Expressions for nuclear-exchange and pseudodipolar interactions are obtained in terms of bond-orbital model parameters. The eigenfunctions and eigenvalues of the Hamiltonian are employed along with standard perturbation theory to calculate the energy shifts resulting from the application of an external electric field and induced by the magnetic interaction between the nuclear spins and the bond-electron spins. The quantitative predictions of the derived formulas are examined for real semiconductors involving elements and compounds from periodic groups III, IV, and V. It is concluded that the present two-electron model makes it possible to assess the quantitative effects of electron correlation in the anion-cation bond for both nonmagnetic properties (electric susceptibility, dielectric constant) and magnetic properties (nuclear-exchange and pseudodipolar interactions) of various materials.
    Keywords: ATOMIC AND MOLECULAR PHYSICS
    Type: Physical Review B - Solid State; vol. 12
    Format: text
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  • 5
    Publication Date: 2019-06-27
    Description: The paper examines the recombination of electrons with ammonium-series cluster ions, NH4(+)-(NH3)n, for two reasons: (1) NH4(+) may be a significant ion in the lower atmospheres of the earth and the outer planets, and (2) to investigate the weak temperature dependence of the cluster ion's recombination coefficient. A microwave afterglow mass spectrometer was used to determine the recombination coefficients for the first five members of the ammonium series, (18+) through (86+), at temperatures between 200 and 410 K. The electron temperature dependence of the recombination coefficient was determined for (35+) and (52+), the n = 1 and 2 cluster ions, over the temperature range 300-3000 K.
    Keywords: ATOMIC AND MOLECULAR PHYSICS
    Type: Physical Review A - General Physics; vol. 14
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