Volker Deringer on Twitter: "Silica (SiO2) is among the most abundant materials. So it seems like a good target for building an accurate #MachineLearning interatomic potential model! A short thread on our
Npj Comput. Mater.: 纳米晶三维结构重建—知识与经验| Redian新闻
npj Computational Materials
Few-Shot Machine Learning Paper Published in npj Comp Mater — Steven R. Spurgeon, Ph.D.
Dishant Beniwal - PhD Research Scholar - Indian Institute of Technology, Ropar | LinkedIn
Marco Govoni
Common workflows for computing material properties using different quantum engines ‒ LSMO ‐ EPFL
Marco Govoni
Ensemble learning-iterative training machine learning for uncertainty quantification and automated experiment in atom-resolved m
npj Computational Materials
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Active learning for accelerated design of layered materials | npj Computational Materials
Volker Deringer on Twitter: "Here's an overview of quality metrics - comparing the new ML potential to empirical ones, and emphasising how tricky it is to find "the best" #compchem method for