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  • 1
    Electronic Resource
    Electronic Resource
    [S.l.] : American Institute of Physics (AIP)
    Journal of Applied Physics 90 (2001), S. 2221-2226 
    ISSN: 1089-7550
    Source: AIP Digital Archive
    Topics: Physics
    Notes: Equilibrium free energies for the α and ω phases of Ti are constructed. The result is a consistent picture of the ambient pressure, static high pressure, and shock data, as well as first-principles electronic structure calculations. The Hugoniot consists of three segments: a metastable α-phase region, a transition region, and an ω-phase branch. All the Hugoniot data are consistent with a transition occurring at ∼12 GPa. An early identification [R. G. McQueen et al., in High Velocity Impact Phenomena, edited by R. Kinslow (Academic, New York, 1970)] of a phase transition at 17.5 GPa appears to have been an artifact. The shock Hugoniot extends further into the metastable region than static data, indicating the existence of a relaxation process occurring on a time scale intermediate between those of the static and dynamic measurements. © 2001 American Institute of Physics.
    Type of Medium: Electronic Resource
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  • 2
    ISSN: 1089-7550
    Source: AIP Digital Archive
    Topics: Physics
    Notes: The importance of including all of Hund's rules in self-consistent electronic-structure calculations in solids is pointed out. We present a scheme that accounts for the interactions that lead to these rules, and we give examples of when these interactions become important. Calculated ground state properties (chemical bonding, magnetic moment, magnetic form factor) of actinide and rare earth systems are found to agree better with experiment when all Hund's rules are accounted for. On the other hand, but also in agreement with experiment, we find that Hund's second and third rule contributions for Fe, Co, and Ni are small.
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    Woodbury, NY : American Institute of Physics (AIP)
    Applied Physics Letters 52 (1988), S. 1636-1638 
    ISSN: 1077-3118
    Source: AIP Digital Archive
    Topics: Physics
    Notes: An ab initio calculation of the magneto-optic Kerr effect is reported for ferromagnetic NiUSn. The double polar Kerr angle 2Φ is predicted to be about 10° in the infrared and about 4° in the visible spectrum. It is concluded that substitutional alloys involving Clb phase materials and uranium atoms are important candidates for device applications.
    Type of Medium: Electronic Resource
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  • 4
    Electronic Resource
    Electronic Resource
    s.l. : American Chemical Society
    Journal of the American Chemical Society 113 (1991), S. 5135-5140 
    ISSN: 1520-5126
    Source: ACS Legacy Archives
    Topics: Chemistry and Pharmacology
    Type of Medium: Electronic Resource
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  • 5
    Electronic Resource
    Electronic Resource
    [s.l.] : Nature Publishing Group
    Nature 410 (2001), S. 759-761 
    ISSN: 1476-4687
    Source: Nature Archives 1869 - 2009
    Topics: Biology , Chemistry and Pharmacology , Medicine , Natural Sciences in General , Physics
    Notes: [Auszug] The equations of quantum mechanics are accurate but difficult to calculate for solids, because the detailed interactions between electrons must be taken into account. For 30 years physicists have been using an approximation known as the density functional theory (DFT), which allows them to ...
    Type of Medium: Electronic Resource
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  • 6
    Electronic Resource
    Electronic Resource
    Springer
    The European physical journal 78 (1990), S. 295-300 
    ISSN: 1434-6036
    Source: Springer Online Journal Archives 1860-2000
    Topics: Physics
    Notes: Abstract The electronic structure of the (001) face of ordered Cu3Au was studied using synchrotron radiation at BESSY, in the photon energy range 22–80 eV. The Cu 3d-derived bands in Cu3Au look like the foldedd-bands of fcc Cu metal. Three Au 5d-derived bands were observed at 5.0, 6.1 and 7.0 eV below the Fermi level, which showed no dispersion with change in photon energy. The Cu 3d- and the Au 5d-derived bands are found to be separated in energy. We have calculated self-consistent energy bands along the (001) direction using the fully relativistic LMTO method. Comparison of these bands with those experimentally determined shows good agreement. From the calculated bands along Γ−X the direction dependent densities of states were determined, which give a consistent account for the non-dispersive Au-bands.
    Type of Medium: Electronic Resource
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  • 7
    Electronic Resource
    Electronic Resource
    Springer
    Journal of low temperature physics 20 (1975), S. 593-636 
    ISSN: 1573-7357
    Source: Springer Online Journal Archives 1860-2000
    Topics: Physics
    Notes: Theoretical calculations and radiofrequency size effect (RFSE) measurements of the electron-phonon scattering rate 1/Τep in potassium are presented. The calculations show that the anisotropy of 1/Τep is very weak (6%rms), being too small to be resolved experimentally. In comparing the theoretical and measured magnitudes of 1/Τep, three corrections to the measured rates are considered in order to extract the rate at the Fermi level. The first concerns the effect of the finite skin depth; the second, the strong energy dependence of the intrinsic electron-phonon scattering rate; and the third, the small-angle nature of the scattering. After investigating these corrections in detail and applying them to the experimentally measured rates, we show that the dispersion of the measured rates is reduced by over a factor of two and that the mean rate is in good agreement with the calculated average rate at the Fermi level.
    Type of Medium: Electronic Resource
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  • 8
    Electronic Resource
    Electronic Resource
    Springer
    Journal of low temperature physics 34 (1979), S. 105-156 
    ISSN: 1573-7357
    Source: Springer Online Journal Archives 1860-2000
    Topics: Physics
    Notes: The memory function formalism is used to derive a generalized golden rule expression for the spin-lattice relaxation rate 1/T 1 for 3He to paramagnetic centers embedded in or residing on surfaces in contact with the 3He. This expression is applied to several simple models of relaxation to paramagnetic spins which do not interact among themselves, both for 3He in the Fermi-liquid phase and for a solid surface layer of 3He on the substrate. The magnitude of 1/T 1 is calculated for each case as well as the temperature and magnetic field dependence. Finally, the relationship between the spin-lattice relaxation rate and the Kapitza conductance across surfaces via magnetic interactions is determined.
    Type of Medium: Electronic Resource
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