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Representation of correlation statistics functions in heterogeneous materials using layered fast spherical harmonics expansion

Journal Article · · Computational Materials Science, 48(1):133-139
Statistical correlation function, including two-point function, is one of the popular methods to digitize microstructure quantitatively. This paper investigated how to represent statistical correlations using layered fast spherical harmonics expansion. A set of spherical harmonics coefficients may be used to represent the corresponding microstructures. It is applied to represent carbon nanotube composite microstructures to demonstrate how efficiently and precisely the harmonics coefficients will characterize the microstructure. This microstructure representation methodology will dramatically improve the computational efficiencies for future works in microstructure reconstruction and property prediction.
Research Organization:
Pacific Northwest National Laboratory (PNNL), Richland, WA (US)
Sponsoring Organization:
USDOE
DOE Contract Number:
AC05-76RL01830
OSTI ID:
1002172
Report Number(s):
PNNL-SA-72122; AF5831060
Journal Information:
Computational Materials Science, 48(1):133-139, Journal Name: Computational Materials Science, 48(1):133-139 Journal Issue: 1 Vol. 48
Country of Publication:
United States
Language:
English