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"Molecular-orbital-based Machine Learning for Open-shell and ..."

Lixue Cheng et al. (2022)

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DOI: 10.48550/ARXIV.2207.08317

access: open

type: Informal or Other Publication

metadata version: 2022-07-19

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Lixue Cheng, Jiace Sun, J. Emiliano Deustua, Vignesh C. Bhethanabotla, Thomas F. Miller III:
Molecular-orbital-based Machine Learning for Open-shell and Multi-reference Systems with Kernel Addition Gaussian Process Regression. CoRR abs/2207.08317 (2022)

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