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Properties of interfaces

In some applications, interfaces between materials with different compositions play an important role. The complexity of calculations of interface characteristics strongly depends on the interface structure and may require the development of a complicated interface model. In general, Kintech Lab can perform calculations of the following data for interfaces:

  • interface energies and stoichiometry
  • adhesion energy
  • work of separation
  • electron work function
  • band offsets
  • localized interface states and interface dipoles

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