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  • Chinese hamster ovary cells  (1)
  • Computational Chemistry and Molecular Modeling  (1)
  • Einstein-Smallwood modification  (1)
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  • 1
    ISSN: 0165-7992
    Keywords: BrdUrd ; Chinese hamster ovary cells ; CldUrd ; Sister-chromatid exchange frequency ; Thymidine, exogenous
    Source: Elsevier Journal Backfiles on ScienceDirect 1907 - 2002
    Topics: Biology , Medicine
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    Springer
    Colloid & polymer science 270 (1992), S. 29-39 
    ISSN: 1435-1536
    Keywords: Van der Waals-networks ; swelling of networks ; filler-loaded networks ; thermodynamics ; Einstein-Smallwood modification
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics
    Notes: Abstract Within the framework of the van der Waals-network model a consistent interpretation of swelling and simple extension in differently crosslinked networks is presented. It is observed that the excess parameters in the Staverman-Koningsveld-Kleintjens version do not depend on the degree of crosslinking. Swelling of filler-loaded rubbers shows universal features because of not depending on the type and the properties of the filler. By introducing the Einstein-Smallwood modification in an adequate manner one understands this phenomenon without any further parameter adjustments. It is the consequence of having “quasi-permanent” filler-to-matrix contacts that are not modified in presence of solvent molecules. The excess-parameters in the swollen matrix are not affected. The entropy elastic stress due to the swelling induced deformation of the matrix is apparently too small as to enforce chain-slippage. The strength of the adhesion of the polymer inhibits filler-to-solvent contacts. These results defend the mean-field treatment of the boundary problem as presented by Einstein-Smallwood, and allows a valuable proof of the thermodynamics of swelling in networks.
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 60 (1996), S. 667-680 
    ISSN: 0020-7608
    Keywords: Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: In the previous article we introduced a method to obtain an ensemble density describing a molecule in a crystal from diffraction experiment structure factors. Here the method is applied to the CoCl42- molecular ion in a Cs3CoCl5 crystal for which accurate magnetic structure factors are known. First, the approximations involved in the interpretation of polarized neutron experiment are reviewed with special emphasis on the collinearity approximation which has been avoided in this work. Second, the derivation of magnetic structure factors corresponding to theoretical ensemble densities is explained (the spin and the exact orbital contributions have been included). Third, the fitting procedure is presented and results at different levels of approximation are discussed. The main conclusions are: (1) A density built by using several molecular wave functions can give a very good agreement with the experimental data. (2) The ensemble representability constraint is necessary to retrieve physical information from the optimized parameters. (3) Taking into account the proper paramagnetic contribution to the magnetization improves significantly the agreement between theory and experiment. (4) Neglecting the diamagnetic contribution and the fact that the magnetization may be locally noncollinear to the applied external field is fully justified for the system under study. © 1996 John Wiley & Sons, Inc.
    Additional Material: 2 Ill.
    Type of Medium: Electronic Resource
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