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  • Open Access

    ARTICLE

    Delocalized Nonlinear Vibrational Modes in Bcc Lattice for Testing and Improving Interatomic Potentials

    Denis S. Ryabov1, Igor V. Kosarev2,3, Daxing Xiong4, Aleksey A. Kudreyko5, Sergey V. Dmitriev2,6,*

    CMC-Computers, Materials & Continua, Vol.82, No.3, pp. 3797-3820, 2025, DOI:10.32604/cmc.2025.062079 - 06 March 2025

    Abstract Molecular dynamics (MD) is a powerful method widely used in materials science and solid-state physics. The accuracy of MD simulations depends on the quality of the interatomic potentials. In this work, a special class of exact solutions to the equations of motion of atoms in a body-centered cubic (bcc) lattice is analyzed. These solutions take the form of delocalized nonlinear vibrational modes (DNVMs) and can serve as an excellent test of the accuracy of the interatomic potentials used in MD modeling for bcc crystals. The accuracy of the potentials can be checked by comparing the… More >

  • Open Access

    PROCEEDINGS

    Equivalent Elastic-Plastic Model of BCC Lattice Structures

    Jie Zhang1, Xu Zhou1, Sanqiang Yang1, Moubin Liu1,*

    The International Conference on Computational & Experimental Engineering and Sciences, Vol.29, No.2, pp. 1-2, 2024, DOI:10.32604/icces.2024.012192

    Abstract The lattice architecture, characterized by its methodical arrangement of repetitive units, exhibits compactness, uniformity, and lightweight properties. In additive manufacturing, such structures are widely utilized in support structures and internal fillings, playing a significant role in improving manufacturing efficiency and optimizing structural performance [1,2]. However, due to the complex microstructure of lattice materials, it is challenging to describe them using refined finite element models. The development of an equivalent performance model for these materials, employing a periodic single cell to represent the internal architecture for the comprehensive lattice system, can significantly improve computational efficiency and… More >

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