High-performance multiphase-field simulations of solid-state phase transformations using Pace3D

E. Schoof, T. Mittnacht, M. Seiz, P. Hoffrogge, H. Hierl and B. Nestler ()
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E. Schoof: Institute of Applied Materials (IAM), Karlsruhe Institute of Technology (KIT)
T. Mittnacht: Institute of Applied Materials (IAM), Karlsruhe Institute of Technology (KIT)
M. Seiz: Institute of Applied Materials (IAM), Karlsruhe Institute of Technology (KIT)
P. Hoffrogge: Institute of Applied Materials (IAM), Karlsruhe Institute of Technology (KIT)
H. Hierl: Institute of Applied Materials (IAM), Karlsruhe Institute of Technology (KIT)
B. Nestler: Institute of Applied Materials (IAM), Karlsruhe Institute of Technology (KIT)

A chapter in High Performance Computing in Science and Engineering '21, 2023, pp 167-184 from Springer

Abstract: Abstract Computational materials science contributes to the accelerated development of new or optimized materials. The phase-field method has established itself as a powerful tool to describe the temporal microstructure evolution during solidphase transformations. The use of high performance computers allows studying the evolution of large, three-dimensional microstructures incorporating phase- and grain boundary specific behaviors as well as phase transitions. This allows a more realistic representation of the phenomena investigated and lead to more reliable predictions of the microstructural evolution. In this work, current applications of the phase-field method are presented using the Pace3D software package and applied at the ForHLR II supercomputer. Additionally, the scaling behavior is shown when using up to 5041 cores.

Date: 2023
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DOI: 10.1007/978-3-031-17937-2_10

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