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Add example XDATCAR to rdf workflow #12

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bjmorgan opened this issue May 4, 2020 · 1 comment
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Add example XDATCAR to rdf workflow #12

bjmorgan opened this issue May 4, 2020 · 1 comment
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bjmorgan commented May 4, 2020

The RadialDistributionFunction example documentation would be more helpful if it included a complete example that parses a pymatgen XDATCAR from a short MD simulation, and plots the resulting rdf.

(cf. #10)
@bjmorgan bjmorgan self-assigned this May 4, 2020
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bjmorgan commented May 5, 2020

Added in a14bd42.

https://vasppy.readthedocs.io/en/latest/examples/rdfs.html

@bjmorgan bjmorgan closed this as completed May 5, 2020
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