Dataset Viewer

The dataset viewer is not available because its heuristics could not detect any supported data files. You can try uploading some data files, or configuring the data files location manually.

YAML Metadata Warning: empty or missing yaml metadata in repo card (https://huggingface.co/docs/hub/datasets-cards)

Charged set Created on Jan 1 2026. The following is used for training (residualized with fukui-2-mace and xdm.) /home/ubuntu/efs/ajc/csp/csp-prod/csp_42ktrain_processed/residualized_32k_1Jan2025_filtered.extxyz

Also included backup of intra dft with fixed splitting and charge intra dft. The following runs where run:

cp /home/ubuntu/efs/ajc/csp/csp_raw_dft/intra_B86bPBEXDM/train/charged_v0/intra_results.extxyz charged_v0_intra_results.extxyz

cp -r ~/efs/ajc/csp/csp_raw_dft/intra_B86bPBEXDM/train/redo_splits_dft redo_splits_intra_dft

cp -r /home/ubuntu/efs/ajc/csp/csp_raw_dft/intra_B86bPBEXDM/train/moeity_charge_intra_45k_30Dec2025 moeity_charge_intra_45k_30Dec2025

Downloads last month: 11