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  • 1
    Electronic Resource
    Electronic Resource
    Springer
    Theoretical chemistry accounts 82 (1992), S. 75-91 
    ISSN: 1432-2234
    Keywords: Polymeric systems ; Pair distribution function ; Stress tensor ; Distribution function
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology
    Notes: Summary The stress tensor of a polymeric system, solution or melt, is the sum of “single molecule” terms which may be expressed as integrals involving the distribution function in the phase space of a single molecule and “intermolecular” terms which involve the distribution function in the configuration space of pairs of molecules. The evaluation of the single molecule terms is usually based on the solution of the “diffusion” equation in the configuration space of a single molecule. In the present development, an analogous “diffusion” equation in the configuration space of a pair of molecules is developed. The development is based on a generalization of the “time-smoothing” ideas introduced by Kirkwood. Expressions are obtained for the various friction coefficients as time correlation functions.
    Type of Medium: Electronic Resource
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