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- .ipynb_checkpoints/error_estimates-checkpoint.ipynb 0 additions, 0 deletions.ipynb_checkpoints/error_estimates-checkpoint.ipynb
- assets/error_estimates/Logo_MPG.png 0 additions, 0 deletionsassets/error_estimates/Logo_MPG.png
- assets/error_estimates/Logo_NOMAD.png 0 additions, 0 deletionsassets/error_estimates/Logo_NOMAD.png
- assets/error_estimates/nomadCoE.png 0 additions, 0 deletionsassets/error_estimates/nomadCoE.png
- assets/error_estimates/periodic_table_binaries.png 0 additions, 0 deletionsassets/error_estimates/periodic_table_binaries.png
- assets/error_estimates/periodic_table_elemental_solids.png 0 additions, 0 deletionsassets/error_estimates/periodic_table_elemental_solids.png
- data/error_estimates/__pycache__/error_estimates_base.cpython-36.pyc 0 additions, 0 deletions...estimates/__pycache__/error_estimates_base.cpython-36.pyc
- data/error_estimates/__pycache__/errorbar_base.cpython-36.pyc 0 additions, 0 deletions.../error_estimates/__pycache__/errorbar_base.cpython-36.pyc
- data/error_estimates/error_bar_binaries.json 0 additions, 0 deletionsdata/error_estimates/error_bar_binaries.json
- data/error_estimates/error_bar_calculations_exciting_results01.db 0 additions, 0 deletions...or_estimates/error_bar_calculations_exciting_results01.db
- data/error_estimates/error_bar_calculations_exciting_results02.db 0 additions, 0 deletions...or_estimates/error_bar_calculations_exciting_results02.db
- data/error_estimates/error_bar_calculations_exciting_results03.db 0 additions, 0 deletions...or_estimates/error_bar_calculations_exciting_results03.db
- data/error_estimates/error_bar_convergence_VASP_170223.db 0 additions, 0 deletionsdata/error_estimates/error_bar_convergence_VASP_170223.db
- data/error_estimates/error_bar_input.json 0 additions, 0 deletionsdata/error_estimates/error_bar_input.json
- data/error_estimates/error_bar_monomers.json 0 additions, 0 deletionsdata/error_estimates/error_bar_monomers.json
- data/error_estimates/error_bar_output_VASP_new.json 0 additions, 0 deletionsdata/error_estimates/error_bar_output_VASP_new.json
- data/error_estimates/error_estimates_base.py 375 additions, 0 deletionsdata/error_estimates/error_estimates_base.py
- data/error_estimates/errorbar_reference.json 0 additions, 0 deletionsdata/error_estimates/errorbar_reference.json
- data/error_estimates/gpaw_monomers_unrelaxed_final.json 0 additions, 0 deletionsdata/error_estimates/gpaw_monomers_unrelaxed_final.json
- data/error_estimates/recommended_POTCAR.dat 97 additions, 0 deletionsdata/error_estimates/recommended_POTCAR.dat
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