DFT computations on surface physical adsorption of hydrocarbons produced in the Fischer-Tropsch synthesis on a CNT/Co nanocatalyst

The physical sorption of several paraffin and olefin hydrocarbons produced in the Fischer-Tropsch (FT) synthesis on the surface of cobalt nanocatalyst supported on (4,4)-armchair carbon nanotube (CNT) was studied using density functional theory (DFT) computations accomplished at B3LYP level of theor...

Full description

Bibliographic Details
Main Authors: Zahra Shariatinia, Molood Abdollahi-Moghadam
Format: Article
Language:English
Published: Elsevier 2018-11-01
Series:Journal of Saudi Chemical Society
Online Access:http://www.sciencedirect.com/science/article/pii/S1319610318300024