Question on which specific database contains energy and forces

[JSLJ23]

In this work, we aim to aid the training of Hamiltonian-predicting models and NNPs for druglike
molecules by significantly extending and improving the nablaDFT dataset [11]. We double the number
of molecules and conformations to 1,936,929 and 12,676,264, respectively.

May I know while database file contains these 12,676,264 conformations with energy and forces?

[KuzmaKhrabrov]

Hello! At this point forces are available for all data splits apart from dataset_train_full and dataset_test_conformations_full and stored in ase_db files.
All the databases are here: nablaDFT/links/energy_databases.json or available through the lightning pipeline.
The databases contain formation energy as well.

Alternately, separate conformations are available as an archive of xyz files here : archive and energies with other DFT properties are stored in csv file: csv file

[JSLJ23]

Do the conformers_archive_v2.tar contain the energy and forces?