access¶
- py4vasp.raw.access(quantity, *, selection=None, path=None, file=None)¶
Create access to a particular quantity from the VASP output.
- Parameters:
quantity (str) – Select which particular quantity to access.
selection (str, optional) – Keyword-only argument to select different sources of the quantity.
path (str, optional) – Keyword-only argument to set the path from which VASP output is read. Defaults to the current directory.
file (str, optional) – Keyword-only argument to set the file from which VASP output is read. Defaults are set in the schema.
- Returns:
Entering the context manager results in access to the desired quantity. Note that the access terminates at the end of the context to ensure all VASP files are properly closed.
- Return type:
ContextManager