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@ARTICLE{Sutmann:49307,
      author       = {Sutmann, G. and Steffen, B.},
      title        = {{A} particle-particle particle-multigrid algorithm for long
                      range interactions in molecular systems},
      journal      = {Computer physics communications},
      volume       = {169},
      issn         = {0010-4655},
      address      = {Amsterdam},
      publisher    = {North Holland Publ. Co.},
      reportid     = {PreJuSER-49307},
      pages        = {343 - 346},
      year         = {2005},
      note         = {Record converted from VDB: 12.11.2012},
      abstract     = {A fast method of order O(N) is proposed to calculate
                      interaction energies and forces in molecular systems with
                      open boundaries, exerted by long range Coulomb interactions.
                      The method consists of a fast multigrid Poisson solver for
                      the far field smooth part of the potential and a
                      particle-particle based method for the near field
                      contribution. Boundary conditions are calculated with a
                      multipole expansion method. Test cases are performed for the
                      performance of the method. (c) 2005 Elsevier B.V. All rights
                      reserved.},
      keywords     = {J (WoSType)},
      cin          = {ZAM},
      ddc          = {004},
      cid          = {I:(DE-Juel1)VDB62},
      pnm          = {Betrieb und Weiterentwicklung des Höchstleistungsrechners},
      pid          = {G:(DE-Juel1)FUEK254},
      shelfmark    = {Computer Science, Interdisciplinary Applications / Physics,
                      Mathematical},
      typ          = {PUB:(DE-HGF)16},
      UT           = {WOS:000230528100075},
      doi          = {10.1016/j.cpc.2005.03.077},
      url          = {https://juser.fz-juelich.de/record/49307},
}