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  • 1
    Electronic Resource
    Electronic Resource
    Dynamics of an ammonium ion in water: Molecular dynamics simulation (1990)
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 93 (1990), S. 5961-5966 
    Details
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: The translational and rotational dynamics of an aqueous ammonium ion are examined using an NVE molecular dynamics computer simulation and a rigid model of water. The linear momentum, angular momentum and reorientational autocorrelation functions of the ammonium ion have been measured. From these, the memory functions for the linear and angular momentum correlation functions are calculated. Reorientation of the ammonium ion about its center of mass shows unambiguous departure from Debye rotational behavior. The translational and rotational diffusion constants have been calculated.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1063/1.459479
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