Abstract
The objective of this research is to examine the use of statistical descriptors in the microstructure reconstruction process and the associated effect on microstructure properties. In this work, two-point correlation functions and lineal path functions were used to study the efficiency and accuracy of microstructure reconstruction. A polar plot of the two-point correlation functions is used to quantitatively evaluate the agreement with the target microstructure. In general, as more microstructure descriptors are added for the microstructure reconstruction process, the computational time increases and the reconstructed microstructures quantitatively agree better with the target microstructure. However, in some cases, adding lineal path functions did not always result in a better microstructural representation. Last, finite element analysis of thermal loading in the reconstructed microstructures of loaded nuclear waste glass is used to evaluate the property predictions with those of the target microstructure. Identifying which statistical descriptors are best for different microstructures may provide insight into optimizing the microstructure reconstruction process from limited statistical descriptors.
Original language | English |
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Pages (from-to) | 437-444 |
Number of pages | 8 |
Journal | Computational Materials Science |
Volume | 51 |
Issue number | 1 |
DOIs | |
State | Published - Jan 2012 |
Externally published | Yes |
Funding
This work was funded by the US Department of Energy’s Nuclear Energy Advanced Modeling and Simulation (NEAMS) program at Pacific Northwest National Laboratory. Microstructure reconstruction part is also partially funded by PNNL LDRD Chemical Imaging Initiative project. PNNL is operated by Battelle Memorial Institute for the US Department of Energy under Contract No. DE-AC05-76RL01830 .
Funders | Funder number |
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US Department of Energy | |
Battelle | |
Pacific Northwest National Laboratory |
Keywords
- Lineal path function
- Microstructure reconstruction
- Statistical correlation
- Two-point correlation function