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The transition temperatures and dynamics for the argon–xenon N=7 mixed cluster series (1990)

Robertson, Daniel H. ; Brown, Franklin B.

College Park, Md. : American Institute of Physics (AIP)

The Journal of Chemical Physics 93 (1990), S. 702-710

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ISSN: 1089-7690

Source: AIP Digital Archive

Topics: Physics , Chemistry and Pharmacology

Notes: Results of molecular-dynamics calculations with quenching for the N=7 Ar–Xe mixed cluster series are reported. The phase-transition temperatures have been determined and are discussed. The microscopic transitions between catchment regions on the potential-energy surface are examined as well as the total amount of time spent in each of these catchment regions. The mixed cluster results are compared to the homogeneous results. The heterogeneous dynamics are found to more closely reproduce the homogeneous results if the heterogeneous catchment regions are classified according to their associated homogeneous parent minimum.

Type of Medium: Electronic Resource

URL: http://dx.doi.org/10.1063/1.459521

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