STRUCTURAL AND MECHANICAL PROPERTIES OF 2D GRAPHENE: A STUDY OF MOLECULAR SIMULATIONS

STRUCTURAL AND MECHANICAL PROPERTIES OF 2D GRAPHENE: A STUDY OF MOLECULAR SIMULATIONS

A graphene model consisting of 12,000 atoms is yielded by molecular dynamics simulation in two-dimensional space. The structural evolution of the graphene model is analyzed in terms of total energy per atom, heat capacity, radial distribution function, coordination number distribution, bond angle d...

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Bibliographic Details
Main Author:	Van Dung Mai
Format:	Article
Language:	English
Published:	Dalat University 2025-05-01
Series:	Tạp chí Khoa học Đại học Đà Lạt
Subjects:	Graphene Mechanical properties Simulation Structure Two-dimension.
Online Access:	https://tckh.dlu.edu.vn/index.php/tckhdhdl/article/view/1437
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