Preview

camml-lab-hubbardml-1537fcb
- .coveragerc
  
  71 Bytes
- .deepsource.toml
  
  284 Bytes
- .editorconfig
  
  289 Bytes
- .flake8
  
  147 Bytes
- .gitattributes
  
  209 Bytes
- .github
  - dependabot.yml
    
    238 Bytes
  - workflows
    - ci.yml
      
      1.3 kB
- .gitignore
  
  7.5 kB
- .pre-commit-config.yaml
  
  1.0 kB
- LICENSE
  
  8.5 kB
- README.md
  
  1.2 kB
- experiments
  - __init__.py
    
    0 Bytes
  - analyse.py
    
    363 Bytes
  - config.yaml
    
    1.0 kB
  - dataset_analysis.ipynb
    
    10.1 kB
  - experiment
    - __init__.py
      
      0 Bytes
    - predict_final.py
      
      1.7 kB
    - predict_final.yaml
      
      224 Bytes
    - predict_final_no_in_param.yaml
      
      305 Bytes
    - predict_from_first_iter.py
      
      4.3 kB
    - predict_from_first_iter.yaml
      
      289 Bytes
    - predict_hp.py
      
      1.4 kB
    - predict_hp.yaml
      
      271 Bytes
    - train.yaml
      
      128 Bytes
  - hubbard_u_olivines.json
    
    3.0 kB
  - mno2.py
    
    5.3 kB
  - mno2.yaml
    
    471 Bytes
  - model
    - u.yaml
      
      647 Bytes
    - v.yaml
      
      462 Bytes
  - olivines.py
    
    6.2 kB
  - olivines.yaml
    
    462 Bytes
  - olivines_analysis.ipynb
    
    12.1 kB
  - predict_iterations.py
    
    3.2 kB
  - predict_iterations.yaml
    
    545 Bytes
  - predict_iterations_analysis.ipynb
    
    7.9 kB
  - prepare_data.py
    
    1.7 kB
  - run.py
    
    7.1 kB
  - utils.py
    
    5.7 kB
- hubbardml
  - __init__.py
    
    730 Bytes
  - datasets.py
    
    10.7 kB
  - engines.py
    
    5.6 kB
  - graphdata.py
    
    3.3 kB
  - graphs.py
    
    26.7 kB
  - keys.py
    
    2.0 kB
  - models.py
    
    4.0 kB
  - parse_pw.py
    
    14.0 kB
  - plots.py
    
    10.3 kB
  - provides.py
    
    310 Bytes
  - qe.py
    
    3.1 kB
  - similarities.py
    
    1.9 kB
  - sites.py
    
    1.5 kB
  - training.py
    
    13.9 kB
  - utils.py
    
    1.4 kB
  - version.py
    
    352 Bytes
- notebooks
  - Equivariant+U.ipynb
    
    12.0 kB
  - Equivariant+V.ipynb
    
    9.4 kB
- pyproject.toml
  
  2.0 kB
- tests
  - __init__.py
    
    39 Bytes
  - conftest.py
    
    1.0 kB
  - test_engines.py
    
    838 Bytes
  - test_models.py
    
    724 Bytes
  - test_qe.py
    
    2.1 kB
  - test_training.py
    
    830 Bytes
  - ylmr2.f90
    
    4.1 kB

hubbardml-v0.2.0.zip