분자동역학을 이용한 탄소나노튜브의 거동 연구Molecular Dynamics Study on the Behavior of a Carbon Nanotube

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Simulations of the buckling behavior of a single wall carbon nanotube(SWCNT) was carried out using molecular dynamics simulation. Molecular dynamics simulations were done with 1fs of time step. Tersoff's potential function was used as the interatomic potential function since it has been proved to be reliable to describe the C-C bonds in carbon nanotubes. Compressive force was applied by moving the top end of the nanotube at a constant velocity. Buckling behavior under compressive load was observed for (15,15) armchair SWCNTs with 2nm of diameter and 24.9nm of length. Buckling load and critical strain is obtained from the MD simulation. Deformation occurred on the top region of the CNT because of fast downward velocity.
Publisher
한국소성가공학회
Issue Date
2007-10-11
Language
KOR
Citation

한국소성가공학회 2007년도 학술대회, pp.348 - 351

URI
http://hdl.handle.net/10203/17953
Appears in Collection
ME-Conference Papers(학술회의논문)

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