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Acquisition Process
Please fill out all required information truthfully.
Personal verification will be completed within two days.
Once approved, you will be granted access to download the content.
ASUGNN.py: The pretrained ASUGNN model
HMdataset.db: A zero-shot test dataset
You can test your model's zero-shot capability by predicting the formation energy per atom using the HMdataset (1,100 data) and upload your results on Kaggle : https://www.kaggle.com/competitions/asugnn.