Descriptor calculation using "elements"

yoshida-lab / XenonPy

XenonPy is a Python Software for Materials Informatics

http://xenonpy.readthedocs.io

BSD 3-Clause "New" or "Revised" License

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Closed stewu5 closed 5 years ago

stewu5 commented 5 years ago

Instead of raising an error when an element is not found, you should have an option to fill in with NaN.