npj Computational Materials (Jan 2022)

Automated pipeline for superalloy data by text mining

  • Weiren Wang,
  • Xue Jiang,
  • Shaohan Tian,
  • Pei Liu,
  • Depeng Dang,
  • Yanjing Su,
  • Turab Lookman,
  • Jianxin Xie

DOI
https://doi.org/10.1038/s41524-021-00687-2
Journal volume & issue
Vol. 8, no. 1
pp. 1 – 12

Abstract

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Abstract Data provides a foundation for machine learning, which has accelerated data-driven materials design. The scientific literature contains a large amount of high-quality, reliable data, and automatically extracting data from the literature continues to be a challenge. We propose a natural language processing pipeline to capture both chemical composition and property data that allows analysis and prediction of superalloys. Within 3 h, 2531 records with both composition and property are extracted from 14,425 articles, covering γ′ solvus temperature, density, solidus, and liquidus temperatures. A data-driven model for γ′ solvus temperature is built to predict unexplored Co-based superalloys with high γ′ solvus temperatures within a relative error of 0.81%. We test the predictions via synthesis and characterization of three alloys. A web-based toolkit as an online open-source platform is provided and expected to serve as the basis for a general method to search for targeted materials using data extracted from the literature.