:py:mod:`aiida_vasp.utils.neb`
==============================

.. py:module:: aiida_vasp.utils.neb

.. autodoc2-docstring:: aiida_vasp.utils.neb
   :allowtitles:

Module Contents
---------------

Functions
~~~~~~~~~

.. list-table::
   :class: autosummary longtable
   :align: left

   * - :py:obj:`neb_interpolate <aiida_vasp.utils.neb.neb_interpolate>`
     - .. autodoc2-docstring:: aiida_vasp.utils.neb.neb_interpolate
          :summary:
   * - :py:obj:`fix_atom_order <aiida_vasp.utils.neb.fix_atom_order>`
     - .. autodoc2-docstring:: aiida_vasp.utils.neb.fix_atom_order
          :summary:

API
~~~

.. py:function:: neb_interpolate(init_structure: aiida.orm.StructureData, final_structure: aiida.orm.StructureData, nimages: aiida.orm.Int) -> dict[str, aiida.orm.StructureData]
   :canonical: aiida_vasp.utils.neb.neb_interpolate

   .. autodoc2-docstring:: aiida_vasp.utils.neb.neb_interpolate

.. py:function:: fix_atom_order(reference: aiida.orm.StructureData, to_fix: aiida.orm.StructureData) -> aiida.orm.StructureData
   :canonical: aiida_vasp.utils.neb.fix_atom_order

   .. autodoc2-docstring:: aiida_vasp.utils.neb.fix_atom_order