Data-driven kinetic energy density fitting for orbital-free DFT: Linear vs Gaussian process regression

Title
Data-driven kinetic energy density fitting for orbital-free DFT: Linear vs Gaussian process regression
Authors
Keywords
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Journal
JOURNAL OF CHEMICAL PHYSICS
Volume 153, Issue 7, Pages 074104
Publisher
AIP Publishing
Online
2020-08-18
DOI
10.1063/5.0015042

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