Temperature Effect on the SO۲ Adsorption in Carbon Nanocone by GCMC Simulation

Sulfur oxides (SO۲) is principal pollutant in the atmosphere due to its harmful impact on human healthand environment. We used Grand Canonical Monte Carlo (GCMC) molecular simulations to study SO۲ gasadsorption in carbon nanocone. To investigate the effect of temperature on the amount of gas absorption in thenanocone, the simulations were performed at ۳۴۸.۱۵, ۲۹۸.۱۵ and ۲۴۸.۱۵ K temperatures. The results indicatedthat as the temperature was increased, the amount of gas absorption decreased

کلیدواژه ها:

Temperature ، Simulation ، Adsorption