ElemNet: Deep Learning the Chemistry of Materials From Only Elemental Composition

Abstract Conventional machine learning approaches for predicting material properties from elemental compositions have emphasized the importance of leveraging domain knowledge when designing model inputs. Here, we demonstrate that by using a deep learning approach, we can bypass such manual feature e...

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Auteurs principaux: Dipendra Jha, Logan Ward, Arindam Paul, Wei-keng Liao, Alok Choudhary, Chris Wolverton, Ankit Agrawal
Format: article
Langue:EN
Publié: Nature Portfolio 2018
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Accès en ligne:https://doaj.org/article/91d0cbe550334e66bd4c6aaf25de24d9
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