Numerical approach to the study of the stressed (0 0 1)NiO/(1 1 1)Ni coatings

• Published in: Computational materials science 2000-12, Vol.19 (1), p.329-338
• Main Authors: Vallino, N., Lahoche, L., Roelandt, J.M., Lorman, V., Rochal, S.B., Gaillet, L., Moulin, G.
• Format: Article
• Language: English
• Subjects: Epitaxial strain; Finite element method; Metal/oxide interface; Micro-structural analysis; Oxidation under loading; Oxide growth; Oxide-scale cracking; Residual stress
• ISSN: 0927-0256; 1879-0801
• DOI: 10.1016/S0927-0256(00)00171-3

This work is devoted to the study of the thermomechanical behaviour of the oxide films formed during the high-temperature oxidation of loaded (1 1 1)Ni single-crystalline nickel samples. The NiO/Ni system is submitted to a high-temperature creep in the oxygen atmosphere. First experiments performed with this system have shown, several deformation modes (diffusional creep, gliding at the interfaces, etc.) in the oxide film and the appearance of periodic cracks perpendicular to the loading direction. The inter-crack distance varies strongly with the load amplitude. In order to clarify these phenomena, we developed two numerical models. Both models take into account the oxide growth phenomenon and consequently the epitaxial strain due to the lattice misfit between the film and the substrate. A simplified 1D model of the oxide layer evolution and a complete 3D finite element model. The results obtained for this model (residual stress and strain and their distribution in the film along the direction perpendicular to the substrate) are used in the 3D model as initial data for the simulation of successive cracks that appear during external loading. For that simulation, we associate remeshing techniques and field mapping. Using the proposed approach, we study, namely, the dissymmetrical coating growth. We analyse also the effect of the crack generation during the loading on the mechanical fields along the metal/oxide interface.