CrysToGraph_matbench

Crystals with Transformers on Graph, run on matbench

python main.py

Name		Name	Last commit message	Last commit date
Latest commit History 84 Commits
model		model
LICENSE		LICENSE
README.md		README.md
atom.py		atom.py
atom_init_118.json		atom_init_118.json
atom_representations_86_1.pt		atom_representations_86_1.pt
atom_vocab.jbl		atom_vocab.jbl
contrastive_pretrained_sd.pt		contrastive_pretrained_sd.pt
data.py		data.py
embeddings_86_64catcgcnn.pt		embeddings_86_64catcgcnn.pt
environment.yml		environment.yml
graph_utils.py		graph_utils.py
info.json		info.json
main.py		main.py
test.py		test.py
train.py		train.py

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