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Initial data generation from VASP #1

@Asif-Iqbal-Bhatti

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@Asif-Iqbal-Bhatti

Hello,

Thank you for the code. I would like to use this technique for my case. Have you provided how the initial data should be organized? I don't see any scripts that generated the AIMD data from VASP, although MACE provides scripts to standardize the data before training.

Further, I see there are no scripts for validation of the model.

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