pyiron.atomistics.structure.atom module¶
-
class
pyiron.atomistics.structure.atom.
Atom
(symbol='X', position=0, 0, 0, tag=None, momentum=None, mass=None, magmom=None, charge=None, atoms=None, index=None, pse=None, element=None, **qwargs)[source]¶ Bases:
pyiron.atomistics.structure.sparse_list.SparseArrayElement
-
property
mass
¶
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property
number
¶
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property
position
¶ XYZ-coordinates
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property
symbol
¶
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property
x
¶ X-coordinate
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property
y
¶ Y-coordinate
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property
z
¶ Z-coordinate
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property
-
pyiron.atomistics.structure.atom.
abcproperty
(index)[source]¶ Helper function to easily create Atom ABC-property.