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oerc0122 / castep_outputs

Parser for CASTEP output files
BSD 3-Clause "New" or "Revised" License
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Refactor parse_standard_header #150

Open oerc0122 opened 3 months ago

oerc0122 commented 3 months ago

parse_standard_header returns un-normalised keys and treats any extra parameters as sequences of floats rather than correctly determining the type.

Fuller discussion in #144