potential_sections

Full name: ase2sprkkr.potentials.potential_sections

Module class hierarchy

Inheritance diagram of ase2sprkkr.potentials.potential_sections.ASEArraySection, ase2sprkkr.potentials.potential_sections.PotentialSection, ase2sprkkr.potentials.potential_sections.UniqueListSection

Description

A potential file for SPRKKR is divided to sections. In this module, there are a generic classes for these sections.

Classes

ASEArraySection(definition[, container])

A section, that get and set the given ASE array (see ASE documentation of the Atoms class), e.g.

PotentialSection(definition[, container])

A generic class for a section in a potential

UniqueListSection(definition[, container])

The section, whose data is list of something, e.g.