Abstract
Rapid solidification experiments have, in recent years, revealed a wealth of new microstructural phenomena that suggest a strong connection between the kinetics of solidification and the crystalline structures that emerge as a result. In this work, we investigate the interplay between interface morphology and defect-mediated processes during rapid solidification conditions using a Phase Field Crystal (PFC) model, enabling us to simultaneously and efficiently explore the physics of solidification and elasto-plasticity in the formalism of a single-field theory. We predict that there are two mechanisms by which dislocations emitted directly from the solid–liquid interface induce orientation gradients as well as the formation of subgrain boundaries within a single solidifying cell. We relate these mechanisms to the morphology of the moving solid–liquid interface and identify a suitable control parameter in the PFC model with which we can go between said morphologies by effectively changing the relative strength of the capillary length and kinetic coefficients of the solid–liquid interface. Thus, we are able to provide mechanistic explanations for several microstructural features (with an emphasis on orientation gradients and subgrain boundaries) observed during the rapid solidification of pure materials. We also provide a simple explanation for the formation of “jagged” subgrain boundaries, which is consistent with our experimental observations in rapidly solidified samples of Aluminum, whose mechanisms have thus far been unknown.
| Original language | English |
|---|---|
| Article number | 121581 |
| Journal | Acta Materialia |
| Volume | 302 |
| DOIs | |
| Publication status | Published - 1 Jan 2026 |
| MoE publication type | A1 Journal article-refereed |
Funding
N.P. thanks The Natural Sciences and Engineering Research Council of Canada (NSERC) and the Canada Research Chairs (CRC) Program for funding support, and the Digital Research Alliance of Canada for computing resources. S.N. acknowledges Alex Mamaev and Salvador Valtierra for insightful conversations over the course of the project. The work of T.P. and A.L. was supported by Research Council of Finland, Grant No. 362197. T.V. and J.T.M.’s work was performed under the auspices of the US Department of Energy by Lawrence Livermore National Laboratory, United States under contract No. DE-AC52-07NA27344.
Keywords
- Interface morphology
- Orientation gradients
- Phase field crystal model
- Rapid solidification
- Subgrain formation