This work is aimed at the development of finite element models and prediction of the mechanical behavior of MXene nanosheets. Using LS-Dyna Explicit software, a finite element model was designed to simulate the nanoindentation process of a two-dimensional MXene Ti3C2Tz monolayer flake and to validate the material model. For the evaluation of the adhesive strength of the free-standing Ti3C2Tz-based film, the model comprised single-layered MXene nanosheets with a specific number of individual flakes, and the reverse engineering method with a curve fitting approach was used. The interlaminar shear strength, in-plane stiffness, and shear energy release rate of MXene film were predicted using this approach. The results of the sensitivity analysis showed that interlaminar shear strength and in-plane stiffness have the largest influence on the mechanical behavior of MXene film under tension, while the shear energy release rate mainly affects the interlaminar damage properties of nanosheets.
This paper presents a computational analysis on the mechanical and damage behavior of novel hybrid polymer composites with graphene and MXene nano-reinforcements targeted for flexible electronics and advanced high-strength structural applications with additional functions, such as real-time monitoring of structural integrity. Geometrical models of three-dimensional representative volume elements of various configurations were generated, and a computational model based on the micromechanical finite element method was developed and solved using an explicit dynamic solver. The influence of the geometrical orientation, aspect ratio, and volume fractions of the inclusions, as well as the interface properties between the nano-reinforcements and the matrix on the mechanical behavior, was determined. The results of the presented research give initial insights about the mechanical and damage behavior of the proposed composites and provide insight for future design iterations of similar multifunctional materials.
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