Ni-C nanostructures are the interesting object of study due to their potential use in field-effect electron emitters.
Investigations of the structures are typically carried out using experimental methods as molecular spectroscopy (FTIR
and Raman). The aim of these investigations is study the influence of metal atoms on formation of carbon structure.
These studies may be expanded through the using of quantum mechanics calculation software.
Some aspects of using a Hyperchem software in study of Ni-C structures will be presented. The simulations were
made for typical structures of carbon (C60 fulleren and graphene) surrounded by metal atoms. The usefulness of the
software in the quantum-mechanics calculations is analysed.
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