httk.atomistic.spacegroup module¶
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class
httk.atomistic.spacegroup.
Spacegroup
(hall_symbol)[source]¶ Bases:
httk.core.httkobject.HttkObject
Represents a spacegroup
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classmethod
create
(spacegroup=None, hall_symbol=None, hm_symbol=None, spacegroupnumber=None, setting=None, symops=None)[source]¶ Create a new spacegroup object,
Give ONE OF hall_symbol or spacegroup.
hall_symbol = a string giving the hall symbol of the spacegroup
- spacegroup = a spacegroup on any reasonable format that can be parsed, e.g.,
- an integer (spacegroup number)
setting = if only a spacegroup number is given, this allows also specifying a setting.
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number
¶
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number_and_setting
¶
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classmethod