casm.vasp.io.SpeciesDict

class casm.vasp.io.SpeciesDict

SpeciesDict subclasses dict so it can hold additional metadata without disrupting routines that

rely on species_setting containing only key/value pairs corresponding to IndividualSpecies

__init__(*args, **kwargs)

Methods

__init__(*args, **kwargs)
clear()
copy()
fromkeys([value])	Create a new dictionary with keys from iterable and values set to value.
get(key[, default])	Return the value for key if key is in the dictionary, else default.
items()
keys()
pop(k[,d])	If key is not found, default is returned if given, otherwise KeyError is raised
popitem()	Remove and return a (key, value) pair as a 2-tuple.
set_available_tags(tags)	Set a metadata member that lists the available tags listed in a SPECIES file
setdefault(key[, default])	Insert key with a value of default if key is not in the dictionary.
update([E, ]**F)	If E is present and has a .keys() method, then does: for k in E: D[k] = E[k] If E is present and lacks a .keys() method, then does: for k, v in E: D[k] = v In either case, this is followed by: for k in F: D[k] = F[k]
values()