4.2 Article

A data ecosystem to support machine learning in materials science

期刊

MRS COMMUNICATIONS
卷 9, 期 4, 页码 1125-1133

出版社

SPRINGER HEIDELBERG
DOI: 10.1557/mrc.2019.118

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资金

  1. U.S. Department of Commerce, National Institute of Standards and Technology, Center for Hierarchical Materials Design (CHiMaD) [70NANB19H005, 70NANB14H012]
  2. National Science Foundation, Midwest Big Data Hub under NSF [1636950]
  3. Argonne National Laboratory under U.S. Department of Energy [DE-AC02-06CH11357]
  4. DOE Office of Science User Facility [DE-AC02-06CH11357]
  5. Direct For Computer & Info Scie & Enginr
  6. Office of Advanced Cyberinfrastructure (OAC) [1636950] Funding Source: National Science Foundation

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Facilitating the application of machine learning (ML) to materials science problems requires enhancing the data ecosystem to enable discovery and collection of data from many sources, automated dissemination of new data across the ecosystem, and the connecting of data with materials-specific ML models. Here, we present two projects, the Materials Data Facility (MDF) and the Data and Learning Hub for Science (DLHub), that address these needs. We use examples to show how MDF and DLHub capabilities can be leveraged to link data with ML models and how users can access those capabilities through web and programmatic interfaces.

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