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Initial repository to track tasks and code snippets. May change name / disappear, etc.
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Magnetisation Prediction Software
#44
Open
samjrholt
opened
1 month ago
fangohr
commented
1 month ago
Possible behaviour:
user puts in chemical composition
system responds (either by displaying to stdout or return data structures for further processing):
if the composition is known
show all known values
might be multiple ones from different data bases (show from which data base they are known in any case)
which crystal structure (might not be unique, then report all results)
also show prediction from model (for fun and to get feel for accuracy of model)
if unknown composition:
show prediction from model
Possible behaviour: