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@ARTICLE{Sutmann:51221,
      author       = {Sutmann, G. and Stegailov, V.},
      title        = {{O}ptimization of neighbor list techniques in liquid matter
                      simulations},
      journal      = {Journal of molecular liquids},
      volume       = {125},
      issn         = {0167-7322},
      address      = {New York, NY [u.a.]},
      publisher    = {Elsevier},
      reportid     = {PreJuSER-51221},
      year         = {2006},
      note         = {Record converted from VDB: 12.11.2012},
      abstract     = {The performance of neighbor list techniques in molecular
                      dynamics simulations depends on a variety of parameters,
                      which may be adjusted for maximum efficiency. Here, a model
                      is presented which allows to choose optimal parameters for
                      the performance of Verlet- and linked-cell lists. In several
                      cases, an efficiency gain of approximate to $50\%$ is found
                      if parameters are chosen adequately. Test cases are
                      presented for Lennard-Jones systems at different state
                      points. Good agreement between analytical model and
                      simulation results is found. (c) 2005 Elsevier B.V All
                      rights reserved.},
      keywords     = {J (WoSType)},
      cin          = {ZAM},
      ddc          = {540},
      cid          = {I:(DE-Juel1)VDB62},
      pnm          = {Scientific Computing},
      pid          = {G:(DE-Juel1)FUEK411},
      shelfmark    = {Chemistry, Physical / Physics, Atomic, Molecular $\&$
                      Chemical},
      typ          = {PUB:(DE-HGF)16},
      UT           = {WOS:000236994000016},
      doi          = {10.1016/j.molliq.2005.11.029},
      url          = {https://juser.fz-juelich.de/record/51221},
}