smac
nablaDFT
smac | nablaDFT | |
---|---|---|
2 | 1 | |
1,001 | 133 | |
2.3% | 3.8% | |
3.8 | 8.6 | |
2 months ago | 8 days ago | |
Python | Python | |
MIT License | MIT License |
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smac
nablaDFT
-
The world's largest quantum chemistry dataset to empower new materials design and drug discovery
https://github.com/AIRI-Institute/nablaDFT here's the dataset itself btw!
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