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Fragmentation of water clusters: Molecular-dynamics simulation study

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Abstract:

The fragmentation of water clusters, [(H 2 O)n;n = 2-8], have been investigated by using molecular-dynamics simulation method. In the simulations a polarizable-dissociable potential energy function for water has been used. Particular attention has bee paid to investigate the effect of structural properties and cluster size on the fragmentation.

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Authors and Affiliations

  1. Department of Physics, Middle East Technical University, 06531 Ankara, Turkey, , , , , , TR

    Ş. Erkoç & H. Kökten

  2. Department of Computer Engineering, Çankaya University, 06530 Ankara, Turkey, , , , , , TR

    Z. Güvenç

Authors
  1. Ş. Erkoç
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  2. H. Kökten
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  3. Z. Güvenç
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Additional information

Received 27 April 2000 and Received in final form 6 October 2000

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Erkoç, Ş., Kökten, H. & Güvenç, Z. Fragmentation of water clusters: Molecular-dynamics simulation study. Eur. Phys. J. D 13, 361–365 (2001). https://doi.org/10.1007/s100530170253

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  • DOI: https://doi.org/10.1007/s100530170253

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