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Advances in multi-scale method based on the bridging domain decomposition in computational materials science

  • Zheng Zhang
  • , Geng Liu
  • , Tian Xiang Liu
  • , Jun Zhi Cui
  • Northwestern Polytechnical University Xian
  • Chinese Academy of Sciences

Research output: Contribution to journalArticlepeer-review

8 Scopus citations

Abstract

There are inherent multi-scale characteristics in materials science. Based on Bridging Domain decomposition techniques the microscopic, meso-scopic or/and nano-scale computation region, such as Molecular Dynamics (MD) and Quantum Mechanics (QM), are introduced into the macroscopic continuum models to couple multiple scale models and methodologies to form an unified computational system. It is called as the Multi-Scale Method based on Bridging Domain decomposition (MSMBD). The physical characteristics of investigated problem can be held by MSMBD algorithm and the computing cost is reduced. In this paper the conception of MSMBD, basic principles, coupled models and discretization methods are discussed, and some examples are given. Finally, several research directions in future are pointed out.

Original languageEnglish
Pages (from-to)652-658
Number of pages7
JournalJisuan Lixue Xuebao/Chinese Journal of Computational Mechanics
Volume23
Issue number6
StatePublished - Dec 2006

Keywords

  • Bridging domain decomposition
  • Continuum mechanics
  • Molecular Dynamics
  • Multi-scale method
  • Quantum Mechanics

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