N-dimensional switch function for energy conservation in multiprocess reaction dynamics

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César Mogo1, João Brandão1

  • 1Centro de Investigação em Química do Algarve, Universidade do Algarve, Faro, Portugal.

Journal of Computational Chemistry
|March 20, 2016
PubMed

Keywords:
N-dimensional switch functionenergy conservationharmonic averagemultiprocess reactive dynamic systems

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