MeshInformationSection

class ase2sprkkr.potentials.definitions.sections.mesh_information.MeshInformationSection(definition, container=None)[source]

Class hierarchy

Inheritance diagram of ase2sprkkr.potentials.definitions.sections.mesh_information.MeshInformationSection

Constructor

__init__(definition, container=None)

Create the container and its members, according to the definition

_value_name: str = 'meshes'

The name of the property of write_io_data to store the list of data

_value_class

alias of ExponentialMesh

_set_from_atoms(atoms, write_io_data)[source]

Set the values of the section from the write_io_data.

Parameters:
_update_atoms(atoms, read_io_data)[source]

Update a ReadIoData object accordingly the data in the section: set its _value_name to list of self_value_class.from_tuple(<data>)

Parameters: