Title of article :
Hydrogen storage capability of carbon nanotube Be@C120
Author/Authors :
Türker، نويسنده , , Lemi and Eroglu، نويسنده , , Inci and Yücel، نويسنده , , Meral and Gündüz، نويسنده , , Ufuk، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2004
Abstract :
PM3 (RHF) type semiempirical quantum chemical calculations have been carried out on (nH2+Be)@C120 systems where C120 is a capped tube and n⩽15. The results indicate that all these systems are stable but endothermic in nature. (7H2+Be)@C120 system has the lowest heat of formation value.
Keywords :
Hydrogen storage , Nanotubes , Endohedral doping , Beryllium , PM3 calculations , Hydrogen
Journal title :
International Journal of Hydrogen Energy
Journal title :
International Journal of Hydrogen Energy
