13–17 Sept 2021 Virtual Conference
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Europe/Vienna timezone
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Convolutional neural network for optimization of LIQUID/IMC interfacial energy in Cu-Sn system using microstructural image datasets from phase field simulations.

Not scheduled
3m
Virtual

Virtual

Poster C13. Wetting, high-temperature capillarity, interface design & modeling C13_Poster Session

Speaker

Dr Anil Kunwar (KU Leuven)

Description

Computational studies of the phase microstructure can assist greatly in the design of Cu-Sn material for joining and energy applications. The phase field method is a very popular method for mechanistic studying of the spatial-temporal evolution of phases in the material’s microstructures. In Cu-Sn system consisting of LIQUID (Sn-rich), IMC (Cu6Sn5) and FCC (Cu-rich) phases at 523.15 K, the knowledge of interfacial energies at the interphase and intergrain boundaries is essential during the development of the multi-phase field model. While the interface energy for the solid/solid (FCC/IMC and IMC/IMC) interfaces has been clearly outlined as 0.3 J/m2 in the literature of previous works, there are several discrepancies regarding the reporting of liquid/solid (LIQUID/IMC and LIQUID/FCC) interfaces. For a computational study having pre-existing IMC grains at the interface of LIQUID and FCC , the LIQUID/FCC interfacial energy (σ_(L/F)) plays a lesser role in guiding the phase morphologies once the IMC attains a layered structure, and so it is assumed to be of a value equal to that of LIQUID/IMC interface energy (σ_(L/I)). This simplifies the system to possessing the uncertainty in only one variable, namely, σ_(L/I). For the present study, based upon the varying interface energy (VIE) formalism, the microstructural image datasets are created by performing simulations with σ_(L/I) designated at different values in the range 0.05-0.25 J/m2. These image datasets are assigned different labels corresponding to values of σ_(L/I) and are then used to train a convolutional neural network. Then the label in the prediction model that best matches with the experimental microstructural image is considered as the optimum LIQUID/IMC interface energy for the Cu-Sn system. Through this study it can be illustrated how microstructural simulation can serve as the source of datasets in the data-driven study of materials’ interfacial energies.

Speaker Country Belgium

Authors

Dr Anil Kunwar (KU Leuven) Dr Johan Hektor (Malmö University) Mrs Ensieh Yousefi (KU Leuven) Mr Youqing Sun (KU Leuven) Prof. David Seveno (KU Leuven) Dr Muxing Guo (KU Leuven) Prof. Nele Moelans (KU Leuven)

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