Skip to Main Content
 

Global Search Box

 
 
 
 

Files

File List


osu1080249965.pdf (5.52 MB)

ETD Abstract Container

Abstract Header

The fundamentals and applications of phase field method in quantitative microstructural modeling

Shen, Chen
http://rave.ohiolink.edu/etdc/view?acc_num=osu1080249965

Abstract Details

2004, Doctor of Philosophy, Ohio State University, Materials Science and Engineering.
The key to predicting and therefore controlling properties of materials is the knowledge of microstructure. As computer modeling and simulation is becoming an important part of materials science and engineering, there is an ever-increasing demand for quantitative models that are able to handle microstructures of realistic complexity at length and time scales of practical interest. The phase field approach has become the method of choice for modeling complicated microstructural evolutions during various phase transformations, grain growth and plastic deformation. Using gradient thermodynamics of non-uniform systems and Langevin dynamics, the method characterizes arbitrary microstructures and their spatial-temporal evolution with field variables, and is capable of simulating microstructures and their evolution under various realistic conditions. However, the adoption of the phase field method in practical applications has been slow because the current phase field microstructure modeling is qualitative in nature. In this thesis, recent efforts in developing the phase field method for quantitative microstructure modeling are presented. This includes extension of the phase field method to situations where nucleation, growth and coarsening occur concurrently, incorporation of anisotropic elastic energy into the nucleation activation energy, and comparison of phase field kinetics for diffusion-controlled phase transformations with Johnson-Mehl-Avrami-Kolmogorov (JMAK) theory. The recent extensions of the phase field method to modeling dislocation networks, dislocation core structures and partial dislocations, and dislocation interactions with γ/γ' microstructures in superalloys are also presented. The length scale limitations and practical approaches to increase simulation length scales for quantitative modeling are discussed for a quite general category of phase field applications. These extensions enable various new understandings of microstructure. For example, coherent precipitates are found to behave similar to dislocations and grain boundaries, causing solute segregation, correlated nucleation and autocatalytic effect. The overall kinetics in diffusion-controlled precipitation agrees with the JMAK prediction only at early stages, and due to soft-impingement and the Gibbs-Thomson effect the later kinetics could deviate considerably. The modified formulations in phase field dislocation model allow studying complex dislocation structures, including networks and dissociated nodes, in a self-consistent way. The introduction of γ-surfaces enables treating dislocation motion in multi-phase microstructure in one model.
Yunzhi Wang (Advisor)
dislocation; phase field; nucleation

Recommended Citations

Citations

  • Shen, C. (2004). The fundamentals and applications of phase field method in quantitative microstructural modeling [Doctoral dissertation, Ohio State University]. OhioLINK Electronic Theses and Dissertations Center. http://rave.ohiolink.edu/etdc/view?acc_num=osu1080249965

    APA Style (7th edition)

  • Shen, Chen. The fundamentals and applications of phase field method in quantitative microstructural modeling. 2004. Ohio State University, Doctoral dissertation. OhioLINK Electronic Theses and Dissertations Center, http://rave.ohiolink.edu/etdc/view?acc_num=osu1080249965.

    MLA Style (8th edition)

  • Shen, Chen. "The fundamentals and applications of phase field method in quantitative microstructural modeling." Doctoral dissertation, Ohio State University, 2004. http://rave.ohiolink.edu/etdc/view?acc_num=osu1080249965

    Chicago Manual of Style (17th edition)

osu1080249965
6,033
© 2004, all rights reserved.
This open access ETD is published by The Ohio State University and OhioLINK.