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Graph dynamical networks for unsupervised learning of atomic scale dynamics in materials

Understanding the dynamical processes that govern the performance of functional materials is essential for the design of next generation materials to tackle global energy and environmental challenges. Many of these processes involve the dynamics of individual atoms or small molecules in condensed ph...

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Bibliographic Details
Published in:Nat Commun
Main Authors: Xie, Tian, France-Lanord, Arthur, Wang, Yanming, Shao-Horn, Yang, Grossman, Jeffrey C.
Format: Artigo
Language:Inglês
Published: Nature Publishing Group UK 2019
Subjects:
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC6573035/
https://ncbi.nlm.nih.gov/pubmed/31209223
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41467-019-10663-6
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