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.. module:: ase.spectrum.doscollection
:synopsis: Density of states collection objects
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Density of states collections
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*The dosdata and doscollection modules contained in ase.spectrum form*
*a new framework, intended to replace the DOS implementations in*
*ase.dft.dos and ase.dft.pdos.*
This module provides DOSCollection and GridDOSCollection objects that
contain a set of related DOS data objects. This would typically
represent partitioned contributions to a density-of-states, such as
atomic contributions to a vibrational spectrum or orbital
contributions to an electronic spectrum.
More details
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.. automodule:: ase.spectrum.doscollection
:members:
:noindex:
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