DocumentCode
3599068
Title
Hydrogen storage in carbon based nanoclusters
Author
Munkhsaikhan G, G. ; Naranchimeg, D. ; Sarantuya, L. ; Khenmedekh, L. ; Sangaa, D. ; Batdemberel, G.
Author_Institution
Sch. of Mater.´s Sci., Mongolian Univ. of Sci. & Technol., Ulaanbaatar, Mongolia
Volume
1
fYear
2013
Firstpage
70
Lastpage
72
Abstract
We have studied the hydrogenation of small, medium sized carbon based nanoclusters. Density functional theory was used to calculate the energy and atomic forces. The average hydrogen binding energy for a hydrogen binding as an atom is calculated for all clusters.
Keywords
atomic forces; binding energy; carbon; density functional theory; hydrogen storage; hydrogenation; nanostructured materials; C; atomic force calculation; average hydrogen binding energy; carbon based nanocluster; density functional theory; energy force calculation; hydrogen storage; hydrogenation;
fLanguage
English
Publisher
ieee
Conference_Titel
Strategic Technology (IFOST), 2013 8th International Forum on
Print_ISBN
978-1-4799-0931-5
Type
conf
DOI
10.1109/IFOST.2013.6616950
Filename
6616950
Link To Document