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Fixes to Potential and Scale #138

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  • Potential schema entries have extraneous "potential" at the end of them (which is not how VASP outputs them)
  • Scale must be VaspData

Second point is related to : #125

sudarshanv01 and others added 30 commits August 1, 2023 14:25
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Is the src/py4vasp/_data folder removed? I am not able to find it. However, there is src/py4vasp/calculation/_structure.py. I guess both of these files are the same.

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That is correct, the contents of _data have been moved to calculation. Accessing the contents of a calculation from calculation = Calculation.from_path(...) should show no difference from earlier.

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