Computer simulation of phase transformation and plastic deformation in IN718 superalloy: Microstructural evolution during precipitation

• Published in: Acta materialia 2014-02, Vol.65, p.270-286
• Main Authors: Zhou, N., Lv, D.C., Zhang, H.L., McAllister, D., Zhang, F., Mills, M.J., Wang, Y.
• Format: Article
• Language: English
• Subjects: Applied sciences; Co-precipitation; Computer simulation; Evolution; Exact sciences and technology; External stress; Mechanical properties and methods of testing. Rheology. Fracture mechanics. Tribology; Metals. Metallurgy; Microstructure; Multiphase; Nickel base alloys; Phase-field method; Precipitates; Precipitation; Spatial distribution; Superalloys; Variant selection
• ISSN: 1359-6454; 1873-2453
• DOI: 10.1016/j.actamat.2013.10.069

Microstructural evolution during co-precipitation of γ′, γ″ and δ phases from a supersaturated γ matrix during aging of superalloy Inconel 718 (IN718) is investigated by computer simulation using the phase-field method. The precipitation model is quantitative, using as model inputs ab initio calculations of elastic constants, experimental data on lattice parameters, precipitate–matrix orientation relationship, interfacial energy of each individual precipitate phase and interdiffusivities, and a Ni–Nb–Al pseudo-ternary thermodynamic database specifically developed for IN718. In order to simulate statistically representative multiphase microstructures observed in the alloy, the Kim–Kim–Suzuki treatment of interfaces is employed. Simulation results show how alloy composition, lattice misfit, external stress, temperature and time affect precipitate microstructure and variant selection during isothermal aging, without any a priori assumptions about key microstructural features including size, shape, volume fraction and spatial distribution of different types of precipitates and different variants of the same precipitate phase. The shapes of precipitates and their coarsening kinetics are analyzed based on the two-dimensional moment invariant. The various multiphase microstructures generated by the simulations have been used as model inputs in a study to investigate how precipitate microstructure (in particular shape and spatial distribution) influences the strength of IN718.