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  • 1
    Digitale Medien
    Digitale Medien
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 95 (1991), S. 4709-4714 
    ISSN: 1089-7690
    Quelle: AIP Digital Archive
    Thema: Physik , Chemie und Pharmazie
    Notizen: Stochastic dynamics simulations of n-alkane melts (C13H28 and C28H58 ) have been performed in order to calculate their static properties. The system consists of linear chains of mass points, which are connected by fixed bond lengths. Each point of a chain is subjected to valence bond and torsional forces. Additionally, nonbonded interactions are taken into account by a truncated, Lennard-Jones potential. The mean-square end-to-end distance and the radius of gyration of the chains as well as the average fraction of trans conformations were calculated and compared with the results obtained by Monte Carlo simulations and by unperturbed rotational isomeric states model calculations. The comparison exhibits very good agreement between the results of the different approaches, and demonstrates the potential advantages of stochastic dynamics simulations for polymeric systems. An investigation of different torsional potentials exhibited the subtle effect of the curvature of the torsional potential on bulk structures.
    Materialart: Digitale Medien
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  • 2
    Digitale Medien
    Digitale Medien
    [S.l.] : American Institute of Physics (AIP)
    Journal of Applied Physics 87 (2000), S. 2708-2718 
    ISSN: 1089-7550
    Quelle: AIP Digital Archive
    Thema: Physik
    Notizen: The spatial relaxation of the electrons in weakly ionized plasmas of atomic and molecular gases acted upon by spatially homogeneous electric fields has been the subject of detailed kinetic studies in recent years. In particular, the relaxation behavior of the electron velocity distribution and of relevant macroscopic transport and dissipation properties of the electrons, initiated by different disturbances, have been systematically investigated and its basic mechanisms analyzed. These studies have revealed that, particularly in atomic plasmas, the electrons generally respond to disturbances with weakly damped, spatially periodic relaxation processes that are characterized by large relaxation lengths and pronouncedly nonlocal properties. Currently, the superposition of magnetic fields gets increasing interest [S. Nakamura, P. L. G. Ventzek, and K. Kitamori, J. Appl. Phys. 85, 2534 (1999)] to additionally control or tune those plasmas that are especially used in plasma processing and laser applications by the imposed magnetic force. This evolution has motivated to extend the spatial relaxation studies to plasmas acted upon by crossed electric and magnetic fields. Thus, based on a consequent kinetic treatment, the present article reports on the considerable modifications of the relaxation behavior of the electrons enforced by the additional electron cyclotron motion in the magnetic field. © 2000 American Institute of Physics.
    Materialart: Digitale Medien
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  • 3
    Digitale Medien
    Digitale Medien
    Oxford, UK; Malden, USA : Blackwell Science Ltd
    European journal of soil science 56 (2005), S. 0 
    ISSN: 1365-2389
    Quelle: Blackwell Publishing Journal Backfiles 1879-2005
    Thema: Geologie und Paläontologie , Land- und Forstwirtschaft, Gartenbau, Fischereiwirtschaft, Hauswirtschaft
    Notizen: The mobility of hydrophobic organic compounds (HOCs) in soils can be influenced by the presence of dissolved organic matter (DOM). While numerous studies have determined interactions of HOCs with humic and fulvic acids, only few data exist on the partitioning of HOCs to natural, non-fractionated DOM as it occurs in soil solutions. In this study, DOM was extracted from 17 soil samples with a broad range of chemical and physical properties, originating from different land uses. The partition coefficients of pyrene to DOM were determined in all soil extracts and for two commercial humic acids using the fluorescence quenching method. For the soil extracts, log KDOC values ranged from 3.2 to 4.5 litres kg−1. For the Aldrich and Fluka humic acids, log KDOC was 4.98 and 4.96 litres kg−1, respectively, thus indicating that they are not representative for soil DOM. After excluding these two values, the statistical analysis of the data showed a significant negative correlation between log KDOC and pH. This was also shown for one sample where the pH was adjusted to values ranging from 3 to 9. A multiple regression analysis suggested that ultraviolet absorbance at 280 nm (an indicator for aromaticity) and the E4:E6 ratio (an indicator for molecular weight) had additional effects on log KDOC. The results indicate that the partitioning of pyrene to DOM is reduced at alkaline pH, probably due to the increased polarity of the organic macromolecules resulting from the deprotonation of functional groups. Only within a narrow pH range was the KDOC of pyrene mainly related to the aromaticity of DOM.
    Materialart: Digitale Medien
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  • 4
    Digitale Medien
    Digitale Medien
    s.l. : American Chemical Society
    Journal of the American Chemical Society 79 (1957), S. 4122-4127 
    ISSN: 1520-5126
    Quelle: ACS Legacy Archives
    Thema: Chemie und Pharmazie
    Materialart: Digitale Medien
    Bibliothek Standort Signatur Band/Heft/Jahr Verfügbarkeit
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  • 5
    Digitale Medien
    Digitale Medien
    s.l. : American Chemical Society
    Journal of the American Chemical Society 79 (1957), S. 4116-4121 
    ISSN: 1520-5126
    Quelle: ACS Legacy Archives
    Thema: Chemie und Pharmazie
    Materialart: Digitale Medien
    Bibliothek Standort Signatur Band/Heft/Jahr Verfügbarkeit
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  • 6
    Digitale Medien
    Digitale Medien
    [S.l.] : American Institute of Physics (AIP)
    Journal of Applied Physics 62 (1987), S. 4398-4403 
    ISSN: 1089-7550
    Quelle: AIP Digital Archive
    Thema: Physik
    Notizen: The role of vibrational and electronic superelastic collisions in collision-dominated He-CO rf bulk plasmas has been studied by solving the time-dependent Boltzmann equation in the presence of different concentrations of vibrational [CO(v=1)] and electronic [CO(a3Π),He(3S)] states. The results, which have been obtained for a field frequency ω of π 107 s−1 Torr−1, show that the presence of excited states is such to markedly enlarge at medium electron energies and to strongly enhance at high energies the electron energy distribution function with large consequences on the related macroscopic quantities of the electrons, particularly on the mean collision frequencies of high threshold inelastic collision processes.
    Materialart: Digitale Medien
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  • 7
    Digitale Medien
    Digitale Medien
    Woodbury, NY : American Institute of Physics (AIP)
    Applied Physics Letters 66 (1995), S. 1211-1213 
    ISSN: 1077-3118
    Quelle: AIP Digital Archive
    Thema: Physik
    Notizen: Infrared reflectivity was measured in situ from single phase layers of Rb1C60 with a thickness of about 4 μm on a {111} face and of about 0.5 μm on a {100} face of C60 single crystals. The fcc→orthorhombic phase transition was traced by a splitting of the F1u (4) mode into three lines within a temperature range of 2° at 404/415 K for a cooling/heating cycle, respectively. The reflectivity spectra remained unchanged after exposing the orthorhombic Rb1C60 to air. Even the fcc phase appears to be vibrationally stable in air up to at least 450 K. The conductivity of the orthorhombic phase shows a weakly activated temperature dependence. © 1995 American Institute of Physics.
    Materialart: Digitale Medien
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  • 8
    Digitale Medien
    Digitale Medien
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 101 (1994), S. 2532-2538 
    ISSN: 1089-7690
    Quelle: AIP Digital Archive
    Thema: Physik , Chemie und Pharmazie
    Notizen: A general model for the description of the stress-strain behavior of polymer networks is introduced. We assume that the network consists of a gas of phantom chains. Its deformation is accounted for by macroscopic constraints, which allow nonaffine behavior on the microscopic scale. The advantage of the model lies in the fact that the number of assumptions is smaller than in other models and—at the same time—the main experimental features are reproduced. Comparison to mechanical deformation experiments shows good agreement with the model.
    Materialart: Digitale Medien
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  • 9
    Digitale Medien
    Digitale Medien
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 104 (1996), S. 4806-4813 
    ISSN: 1089-7690
    Quelle: AIP Digital Archive
    Thema: Physik , Chemie und Pharmazie
    Notizen: The adsorption of a single polymer chain onto a solid surface is investigated by molecular dynamics simulations. The chain is composed of mass points interacting via a truncated Lennard-Jones potential, i.e., the excluded volume interaction is taken into account, and grafted to the surface with one end. The average adsorption degree is calculated for various chain lengths (N = 16, 32, 64, 128) and adsorption energies. In addition, the scaling behavior of the adsorption degree and the radius of gyration is investigated. The adsorption degree and the average length of loops and tails are obtained for chains of various stiffnesses. In this context, we find that stiffer chains adsorb more easily. Moreover, the distribution of the mass points perpendicular to the surface as well as the orientation of the bonds with respect to the surface is discussed for various adsorption energies and stiffnesses. © 1996 American Institute of Physics.
    Materialart: Digitale Medien
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  • 10
    Digitale Medien
    Digitale Medien
    s.l. : American Chemical Society
    Analytical chemistry 35 (1963), S. 772-773 
    ISSN: 1520-6882
    Quelle: ACS Legacy Archives
    Thema: Chemie und Pharmazie
    Materialart: Digitale Medien
    Bibliothek Standort Signatur Band/Heft/Jahr Verfügbarkeit
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