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How to add CSV output files?
Takafumi Shiraogawa edited this page Jul 14, 2021
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For example, energies.csv and dipoles.csv are created in analyse or analyse_general in physics.py.
pandas (imported as pd) can be used as
pd.DataFrame(result_energies).to_csv("energies.csv",index=False)
where result_energies is a dictionary.
- Modulate returned outputs of predict_all_targets_general in physics.py.
- Add outputs of analyse_general in physics.py.