@Article{JAMS-3-4, author = {Xiu-Ying, Liu and Zhang, Li-Ying and Xiao-Feng, Li and Kang, Guang-Sheng and Zhi-Qin, Fan}, title = {Theoretical Comparative Study on Hydrogen Storage of $BC_3$ and Carbon Nanotubes}, journal = {Journal of Atomic and Molecular Sciences}, year = {2012}, volume = {3}, number = {4}, pages = {367--374}, abstract = {
We have applied the grand canonical Monte Carlo method (GCMC) to investigate the physisorption properties of hydrogen storage in $BC_3$ and carbon nanotubes, respectively. Some important physical amounts under different temperatures and pressures, such as adsorption isotherms and adsorption amounts were studied. The results show that, the physisorption properties of $BC_3$ nanotube are superior to those of carbon nanotube at all conditions. The main reasons causing such different results between them were analyzed from the interaction energies among nanotubes and $H_2$ molecules.
}, issn = {2079-7346}, doi = {https://doi.org/10.4208/jams.121011.011412a}, url = {https://global-sci.com/article/74393/theoretical-comparative-study-on-hydrogen-storage-of-bc-3-and-carbon-nanotubes} }