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  • 1
    Electronic Resource
    Electronic Resource
    s.l. : American Chemical Society
    Analytical chemistry 45 (1973), S. 2185-2191 
    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
    Analytical chemistry 45 (1973), S. 2327-2330 
    ISSN: 1520-6882
    Source: ACS Legacy Archives
    Topics: Chemistry and Pharmacology
    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 73 (1993), S. 6044-6046 
    ISSN: 1089-7550
    Source: AIP Digital Archive
    Topics: Physics
    Notes: Coercivities up to 1.9 T were achieved by bonding micron-size Sm2Fe17Nx particles with zinc. X-ray analysis of Zn-bonded samples indicates the presence of the ZnFe Γ phase and no unreacted Zn, after heat treatment at about 390 °C for 100 min for samples with Zn content varying from 5 to 35 wt. %. The increase of coercivity occurs only for a more intense heat treatment, e.g., at 390 °C for 300 min or 425 °C for 100 min. Differential scanning calorimetry (DSC) shows two exothermic peaks at 388 and 426 °C, but no endothermic peak related to the melting of Zn (at 419.6 °C) was observed. In dilatometric measurements two peaks were observed for the rate of length change near the same temperatures as the DSC peaks. Polarization-versus-field curves point to an additional ferromagnetic phase with (i) a Curie temperature near 180 K and (ii) 2% of the net magnetization at low temperatures. The corresponding dip in low-temperature demagnetization curves, however, is about 10% in depth. Most of the Sm2Fe17Nx grains in the demagnetized Zn-bonded magnets are multidomain. We found γ≈3.4×10−2 J/m2 and Dc≈0.3 μm for the wall energy and for the critical single-domain particle diameter, respectively.
    Type of Medium: Electronic Resource
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  • 4
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 96 (1992), S. 9239-9240 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Type of Medium: Electronic Resource
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  • 5
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 95 (1991), S. 6658-6667 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: We consider in the present paper the quantum-mechanical effects on the equilibrium and dynamical behavior of low-temperature rare-gas clusters. Using a combination of ground-state and finite-temperature Monte Carlo methods, we examine the properties of small (2–7 particles) neon clusters. We find that the magnitude of the equilibrium quantum-mechanical effects in these systems is significant. The present studies also suggest that the low-temperature dynamics of these rare-gas systems is appreciably nonclassical.
    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 89 (1988), S. 1681-1694 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: The Grassberger–Procaccia method has been employed to study the transitions which occur as a classical Ar3 cluster, modeled by pairwise Lennard-Jones potentials, passes from a rigid, solid-like form to a nonrigid, liquid-like form with increasing energy. Power spectra and lower bounds on the fractal dimensions and K entropies are presented at several energies along the caloric curve for the Ar3 cluster. In addition, the full spectrum of Liapunov exponents has been computed at these same energies to get an accurate value of the K entropy. Chaotic behavior, though relatively small, is observed even at low energies where the power spectrum displays largely normal-mode structure. The degree of chaotic behavior increases with energy at energies where some degree of regularity is observed in the spectrum. However, at energies that just allow the system to pass into and across saddle regions separating local potential minima, the phase space appears to be separable into a region within the equilateral triangle potential well where the behavior is highly chaotic, and a region of lower dimensions and less chaos around the saddle of the linear configuration. Dimensions from approximately three to eight are observed. A clear separability of time scales for establishment of different extents of ergodicity permits the determination of fractal dimensions of the manifold on which the phase points moves, for time scales of physical, i.e., observable significance. We believe this to be the first evaluation of the dimensionality of the space on which the phase point moves, for a Hamiltonian system displaying this range of dimensions.
    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 88 (1988), S. 5300-5306 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: CD3 radicals were generated by excimer laser photolysis (248 nm) of CD3 I, and the transient populations detected by diode laser absorption using a gated integrator signal averager. The v2 =1←0, 2←1, and 3←2 bands of the CD3 radical were observed, and band center frequencies were determined to be 457.8133(11), 507.9311(19), and 542.4510(29) cm−1, respectively. Observed transitions were fitted, by least squares analysis, to yield rotational and centrifugal distortion constants and spin–rotation parameters, and results are compared to theory. Measurements were also carried out of the time dependence of the vibration–rotation level populations as a function of vibrational excitation and spin component.
    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 94 (1991), S. 6644-6659 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: We compute energy levels and wave functions of Ne, Ar, Kr, and Xe trimers, modeled by pairwise Lennard-Jones potentials, using the discrete variable representation (DVR) and the successive diagonalization-truncation method. For the Ne and Ar trimers, we find that almost all of the energy levels lie above the energy required classically to achieve a collinear configuration. For the Kr and Xe trimers, we are able to determine a number of energy levels both below the classical transition energy as well as above it. Energy level statistics for these heavier clusters reveal behavior that correlates well with classical chaotic behavior that has previously been observed above the transition energy. The eigenfunctions of these clusters show a wide variety of behavior ranging from very regular behavior for low lying eigenstates to a combination of regular and irregular behavior at energies above the transition energy. These results, along with quantum Monte Carlo calculations of the ground states for a variety of small clusters, lead to the construction of a local mode model for the eigenstates of these clusters. This simple model reproduces quite well many of the calculated energy levels. From the findings here, a simple picture emerges for quantum mechanical clusters of Ne, Ar, Kr, and Xe that correlates very strongly to classical models of these systems.
    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 91 (1989), S. 3470-3476 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: The successive diagonalization–truncation method is applied to the calculation of the vibrational eigenvalues of the Ar trimer bound by pairwise Lennard-Jones potentials. The statistics of the eigenvalues reveal strongly chaotic behavior of the cluster, consistent with the classical dynamics studies. Moreover, the zero-point energy is higher than the highest energy at which regular dynamics were found classically, indicating that for all energies physically accessible to the cluster, the dynamics are chaotic.
    Type of Medium: Electronic Resource
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  • 10
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 94 (1991), S. 5917-5926 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: We present rovibrational energies and transition intensities for H2O calculated at several levels of approximation, beginning with the adiabatic approximation (separating slow bending and rotation from fast stretching modes), then coupling the slow modes with the symmetric stretch, and culminating with the inclusion of all the couplings in the Hamiltonian. Evaluation of each approximation is made by comparing the results of the ab initio spectra to experiment. A space-fixed rovibrational basis set is used for the variational calculations.
    Type of Medium: Electronic Resource
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