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Datasets:
microsoft
/
msr-acc-tae25
like
5
Follow
Microsoft
19.7k
Modalities:
Tabular
Text
Formats:
parquet
Size:
10K - 100K
ArXiv:
arxiv:
2506.14492
arxiv:
2506.14665
Tags:
total-atomization-energies
quantum-chemistry
computational-chemistry
chemistry
coupled-cluster
Libraries:
Datasets
pandas
Polars
+ 1
License:
cdla-permissive-2.0
Dataset card
Data Studio
Files
Files and versions
xet
main
msr-acc-tae25
133 MB
2 contributors
History:
5 commits
awvwgk
Reference Skala preprint
f61c01d
verified
14 days ago
.gitattributes
Safe
2.5 kB
initial commit
15 days ago
README.md
Safe
7.6 kB
Reference Skala preprint
14 days ago
msr-acc-tae25-all.parquet
66.7 MB
xet
Add MSR-ACC/TAE25 datasets
15 days ago
msr-acc-tae25-train.parquet
Safe
65.7 MB
xet
Add MSR-ACC/TAE25 datasets
15 days ago
msr-acc-tae25-valid.parquet
718 kB
xet
Add MSR-ACC/TAE25 datasets
15 days ago