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QM7-X

The dataset used for training scalable graph foundation models (GFM) for atomistic materials modeling.

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Cite this as

Massimiliano Lupo Pasini, Jong Youl Choi, Kshitij Mehta, Pei Zhang, David Rogers, Jonghyun Bae, Khaled Z. Ibrahim, Ashwin M. Aji, Karl W. Schulz, Jord`a Polo (2024). Dataset: QM7-X. https://doi.org/10.57702/fmg2n58n

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Additional Info

Field	Value
Created	December 2, 2024
Last update	December 2, 2024
Author	Massimiliano Lupo Pasini
More Authors	Jong Youl Choi Kshitij Mehta Pei Zhang David Rogers Jonghyun Bae Khaled Z. Ibrahim Ashwin M. Aji Karl W. Schulz Jord`a Polo
Homepage	https://doi.org/10.1021/acs.jctc.0c01156