MOLECULAR DYNAMICS STUDIES ON THE STRENGTH PREDICTION OF INTERFACE BETWEEN AL-AL4C3 IN METAL MATRIX NANOCOMPOSITES

Deni Haryadi
Advanced Materials Laboratory, Department of Mechanical Engineering, Gunadarma University
Indonesia
Haris Rudianto
Advanced Materials Laboratory, Department of Mechanical Engineering, Gunadarma University
Indonesia
Mohamad Yamin
Advanced Materials Laboratory, Department of Mechanical Engineering, Gunadarma University
Indonesia

Abstract

In this study, molecular dynamics simulations (MD) will be applied to modelling the Al4C3-aluminum interface in aluminum nanocomposite, Al4C3 is an interface that results from the shaker mill process which becomes a bridge that plays an important role in Carbon particles with Aluminium Matrix and Based on observations from the TEM characterization, it is found that the relationship between Al orientation to Al4C3 is (111) (002) (220). The characteristics of the interface between Aluminum matrix and Al4C3 will be analyzed using uniaxial tension and shear test simulation. The atomic potential used in this simulation is the embedded atomic method (EAM) for Al, empirical-order intermolecular potential (AIREBO) for C and lennard jones for the reaction of Al-C atom. The result shows that, the interface orientation is Al matrix (002) || Al4C3 (003) has the highest interface strength compared to Al matrix (111) || Al4C3 (003) and Al matrix (200) Interface orientation || Al4C3 (003). Results from the molecular dynamics simulations are also discussed with analytical results obtained experimental

Keywords
Molecular dynamics, Interface, Aluminum Nanocomposite
References

Liu, Xinghai, Enzuo Liu, Jiajun Li, Chunnian He, and Naiqin Zhao. "Investigation of the evolution and strengthening effect of aluminum carbide for in-situ preparation of carbon nanosheets/aluminum composites." Materials Science and Engineering: vol764, p.138139. 2019 Available: https://www.sciencedirect.com/science/article/abs/pii/S0921509319309256. [Accessed Dec. 1, 2019].

Alfonso, I., Navarro, O., Vargas, J., Beltrán, A., Aguilar, C., González, G. and Figueroa, I.A . “FEA evaluation of the Al4C3 formation effect on the Young’s modulus of carbon nanotube reinforced aluminum matrix composites”. Composite Structures, Vol 127, pp.420-425. 2015Available: https://www.sciencedirect.com/science/article/pii/S0263822315002056/ [Accessed Dec. 1, 2019].

Che, Z., Zhang, Y., Li, J., Zhang, H., Wang, X., Sun, C., Wang, J. and Kim, M.J. “Nucleation and growth mechanisms of interfacial Al4C3 in Al/diamond composites”. Journal of Alloys and Compounds, Vol 65 no 7, pp.81-89, 2016 Available: https://www.sciencedirect.com/science/article/abs/pii/S0925838815313311 [Accessed Dec. 1, 2019].

Wang, J., Guo, L.N., Lin, W.M., Chen, J., Liu, C.L., Zhang, S. and Zhen, T.T. “Effect of the graphene content on the microstructures and properties of graphene/aluminum composites”. New Carbon Materials, Vol 34 no 3, pp.275-285, 2019Available: https://www.sciencedirect.com/science/article/pii/S1872580519600168[Accessed Nov. 2, 2019].

Guo, B., Chen, B., Zhang, X., Cen, X., Wang, X., Song, M., Ni, S., Yi, J., Shen, T. and Du, Y.“Exploring the size effects of Al4C3 on the mechanical properties and thermal behaviors of Al-based composites reinforced by SiC and carbon nanotubes”. Carbon, Vol 135, pp.224-235, 2018Available: https://www.sciencedirect.com/science/article/abs/pii/S0008622318304093[Accessed Nov 9, 2019].

Yan, L., Tan, Z., Ji, G., Li, Z., Fan, G., Schryvers, D., Shan, A. and Zhang, D. “A quantitative method to characterize the Al4C3-formed interfacial reaction: The case study of MWCNT/Al composites”. Materials Characterization, Vol 112, pp.213-218, 2016Available:https://www.sciencedirect.com/science/article/pii/S1044580315301029[Accessed Agut. 4, 2019].

Mokhalingam, A., Dinesh Kumar, and Ashish Srivastava. "Mechanical behaviour of graphene reinforced aluminum nano composites." Materials Today: Proceedings 4.2 pp 3952-3958. 2017: Available: https://www.sciencedirect.com/science/article/pii/S2214785317305059/[Accessed Jan. 10, 2019].

Alian, A. R., M. A. N. Dewapriya, and S. A. Meguid. "Molecular dynamics study of the reinforcement effect of graphene in multilayered polymer nanocomposites." Materials & Design Vol 124 pp. 47-57, 2018 Available: https://www.sciencedirect.com/science/article/abs/pii/S0264127517303003[Accessed Dec. 4, 2019].

Liu, X., Li, J., Liu, E., Li, Q., He, C., Shi, C. and Zhao, N. “Effectively reinforced load transfer and fracture elongation by forming Al4C3 for in-situ synthesizing carbon nanotube reinforced Al matrix composites”. Materials Science and Engineering: Vol 71, pp.182-189 2018 .Available: https://www.sciencedirect.com/science/article/pii/S2214785317305059/[Accessed Dec. 1, 2019].

Solozhenko, Vladimir L., and Oleksandr O. Kurakevych. "Equation of state of aluminum carbide Al4C3." Solid state communications Vol 133. No 6, 385-388, 2005Available: https://www.sciencedirect.com/science/article/abs/pii/S0038109804009913 [Accessed Dec. 1, 2019].

Choi, Bong Kyu, Gil Ho Yoon, and Seungjun Lee. "Molecular dynamics studies of CNT-reinforced aluminum composites under uniaxial tensile loading." Composites Part B: Engineering Vol 91,pp. 119-125, 2016:.Available: https://www.sciencedirect.com/science/article/abs/pii/S1359836816000263[Accessed Dec. 15, 2019].

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