Published September 7, 2024
| Version v2
Model
Open
Deep Potential and Deep Wannier models for KH2PO4&KD2PO4
Authors/Creators
-
1.
Princeton University
Description
DPGEN_param.json: Parameters for the active learning agent DPGEN (for training SCAN model)
KDP_DP_Train.json & KDP_DW_Train.json: Training parameters for the SCAN Deep Potential and Deep Wannier models
KDP_DP_Script.sh & KDP_DW_Script.sh: Training scripts for the SCAN Deep Potential and Deep Wannier models
KDP_DP_Model.pb & KDP_DW_Model.pb: The productive SCAN Deep Potential and Deep Wannier models. Tested with DeePMD-Kit v2.0.3
DPGEN_param_vdwDF.json: Parameters for the active learning agent DPGEN (for training vdw-DF model)
KDP_DP_vdwDF_Train.json: Training parameters for the vdw-DF Deep Potential model.
KDP_DP_vdwDF_Model.pb: The vdw-DF Deep Potential model.
Files
DPGEN_param.json
Files
(239.7 MB)
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Additional details
Related works
- Is supplement to
- Preprint: arXiv:2404.08125 (arXiv)