Integrating multiple materials science projects in a single neural network

Traditionally, machine learning for materials science is based on database-specific models and is limited in the number of predictable parameters. Here, a versatile graph-based neural network can integrate multiple data sources, allowing the prediction of more than 40 parameters simultaneously.

Bibliographic Details
Main Authors: Kan Hatakeyama-Sato, Kenichi Oyaizu
Format: Article
Language:English
Published: Nature Publishing Group 2020-07-01
Series:Communications Materials
Online Access:https://doi.org/10.1038/s43246-020-00052-8
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spelling doaj-df9217b218ca4e14b7b2a461db83f7d62021-08-01T11:15:57ZengNature Publishing GroupCommunications Materials2662-44432020-07-011111010.1038/s43246-020-00052-8Integrating multiple materials science projects in a single neural networkKan Hatakeyama-Sato0Kenichi Oyaizu1Department of Applied Chemistry, Waseda UniversityDepartment of Applied Chemistry, Waseda UniversityTraditionally, machine learning for materials science is based on database-specific models and is limited in the number of predictable parameters. Here, a versatile graph-based neural network can integrate multiple data sources, allowing the prediction of more than 40 parameters simultaneously.https://doi.org/10.1038/s43246-020-00052-8
collection DOAJ
language English
format Article
sources DOAJ
author Kan Hatakeyama-Sato
Kenichi Oyaizu
spellingShingle Kan Hatakeyama-Sato
Kenichi Oyaizu
Integrating multiple materials science projects in a single neural network
Communications Materials
author_facet Kan Hatakeyama-Sato
Kenichi Oyaizu
author_sort Kan Hatakeyama-Sato
title Integrating multiple materials science projects in a single neural network
title_short Integrating multiple materials science projects in a single neural network
title_full Integrating multiple materials science projects in a single neural network
title_fullStr Integrating multiple materials science projects in a single neural network
title_full_unstemmed Integrating multiple materials science projects in a single neural network
title_sort integrating multiple materials science projects in a single neural network
publisher Nature Publishing Group
series Communications Materials
issn 2662-4443
publishDate 2020-07-01
description Traditionally, machine learning for materials science is based on database-specific models and is limited in the number of predictable parameters. Here, a versatile graph-based neural network can integrate multiple data sources, allowing the prediction of more than 40 parameters simultaneously.
url https://doi.org/10.1038/s43246-020-00052-8
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AT kenichioyaizu integratingmultiplematerialsscienceprojectsinasingleneuralnetwork
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