Multiscale simulation of ion beam impacts on a graphene surface

Dybyspayeva, K. B.; Zhuldassov, A.; Ainabayev, A.; Vyatkin, A. F.; Alekseev, K.; Insepov, Z.

dc.contributor.author	Dybyspayeva, K. B.
dc.contributor.author	Zhuldassov, A.
dc.contributor.author	Ainabayev, A.
dc.contributor.author	Vyatkin, A. F.
dc.contributor.author	Alekseev, K.
dc.contributor.author	Insepov, Z.
dc.date.accessioned	2017-09-27T03:17:26Z
dc.date.available	2017-09-27T03:17:26Z
dc.date.issued	2016-09
dc.identifier.citation	Dybyspayeva, K. B., Zhuldassov, A., Ainabayev, A., Vyatkin, A. F., Alekseev, K., & Insepov, Z. (2016, September). Multiscale simulation of ion beam impacts on a graphene surface. In Journal of Physics: Conference Series (Vol. 751, No. 1, p. 012029). IOP Publishing.	ru_RU
dc.identifier.uri	doi:10.1088/1742-6596/751/1/012029
dc.identifier.uri	http://nur.nu.edu.kz/handle/123456789/2702
dc.description.abstract	Multiscale study of single and multilayer graphene irradiation is presented in this paper. Ab-initio density-functional theory (DFT) was used to study point defects, and a large scale parallel molecular-dynamics (MD) simulations were used for studying formation of gas cluster ion impacts. Moreover, Raman spectra of pure and defect graphene samples were studied from DFT calculations. Threshold energies for creating craters on the surface of graphene were obtained from MD and compared with published papers. The results of simulations were also compared with experimental craters and surface shape.	ru_RU
dc.language.iso	en	ru_RU
dc.publisher	IOP Publishing	ru_RU
dc.rights	Open Access - the content is available to the general public	ru_RU
dc.rights	Attribution-NonCommercial-ShareAlike 3.0 United States	*
dc.rights.uri	http://creativecommons.org/licenses/by-nc-sa/3.0/us/	*
dc.subject	graphene irradiation	ru_RU
dc.subject	ion beam	ru_RU
dc.subject	graphene	ru_RU
dc.subject	Molecular Dynamics (MD)	ru_RU
dc.title	Multiscale simulation of ion beam impacts on a graphene surface	ru_RU
dc.type	Conference Paper	ru_RU