Modelling atomic and nanoscale structure in the silicon–oxygen system through active machine learning

Abstract Silicon–oxygen compounds are among the most important ones in the natural sciences, occurring as building blocks in minerals and being used in semiconductors and catalysis. Beyond the well-known silicon dioxide, there are phases with different stoichiometric composition and nanostructured c...

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Bibliographic Details
Main Authors: Linus C. Erhard, Jochen Rohrer, Karsten Albe, Volker L. Deringer
Format: Article
Language:English
Published: Nature Portfolio 2024-03-01
Series:Nature Communications
Online Access:https://doi.org/10.1038/s41467-024-45840-9