Acta Metallurgica Sinica (English Letters) ›› 1999, Vol. 12 ›› Issue (4): 531-533.

• Research paper • Previous Articles     Next Articles

TIGHT BINDING MOLECULA RDNAMICS SIMULATION FORH C_(60)COLLISION:APOSSIBILITY OF H@ C60

Y.T. Fang and C.L. Luo Departmentof Physics, Nanjing Normal University , Naniing 210097 ,China   

  • Received:1999-08-25 Revised:1999-08-25 Online:1999-08-25 Published:2009-10-10

Abstract: Collision between C60 — and Hatom areinvestigatedbytight binding molecular dynamicssimu lation . When Hatom with kineticenergy 5eVhitthecenter of a six membered ring of C60 — , or with kineticenergy 6ev hitsthecenterofa five memberedring of C60 , H@ C60 iscreated. Ifthekineticenergyislower,the Hatom staysoutside, and C60 is deformed bytheshock.

Key words: tight binding MD, H@ C60