Some aspects of using the Hyperchem software in study of Ni-C nanostructures

Radoslaw Belka; Karol Piwowarczyk

doi:10.1117/12.871985

14 September 2010 Some aspects of using the Hyperchem software in study of Ni-C nanostructures

Radoslaw Belka, Karol Piwowarczyk

Proceedings Volume 7745, Photonics Applications in Astronomy, Communications, Industry, and High-Energy Physics Experiments 2010; 774518 (2010) https://doi.org/10.1117/12.871985
Event: Photonics Applications in Astronomy, Communications, Industry, and High-Energy Physics Experiments 2010, 2010, Wilga, Poland

Abstract

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.

Citation Download Citation

Radoslaw Belka and Karol Piwowarczyk "Some aspects of using the Hyperchem software in study of Ni-C nanostructures", Proc. SPIE 7745, Photonics Applications in Astronomy, Communications, Industry, and High-Energy Physics Experiments 2010, 774518 (14 September 2010); https://doi.org/10.1117/12.871985

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KEYWORDS

Fullerenes

Nickel

Chemical species

Nanostructures

Carbon

Graphene

Raman spectroscopy

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