Important descriptors and descriptor groups of Curie temperatures of rare-earth transition-metal binary alloys
arXiv:1809.04750 · doi:10.7566/JPSJ.87.113801
Abstract
We analyze Curie temperatures of rare-earth transition metal binary alloys with machine learning method. In order to select important descriptors and descriptor groups, we introduce newly developed subgroup relevance analysis and adopt the hierarchical clustering in the representation. We execute the exhaustive search and successfully illustrate the importance of descriptors and descriptor groups. We execute the exhaustive search and illustrate that our approach indeed leads to the successful selection of important descriptors and descriptor groups. It helps us to choose the combination of the descriptors and to understand the meaning of the selected combination of descriptors.
16 pages, 8 figures
References in corpus (5)
- Big Data of Materials Science - Critical Role of the Descriptor
- Quantum Theory of Rare-Earth Magnets
- Magnetism of iron and nickel from rotationally invariant Hirsch-Fye quantum Monte Carlo calculations
- Nonlocal correlations in the vicinity of the - phase transition in iron within a DMFT plus spin-fermion model approach
- A regression-based feature selection study of the Curie temperature of transition-metal rare-earth compounds: prediction and understanding
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