کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
6456240 | 1419844 | 2017 | 8 صفحه PDF | دانلود رایگان |
- Nitrogen doped graphene can self-assemble into nitrogen doped carbon nanoscrolls.
- Nitrogen doped carbon nanoscrolls show excellent CO2 uptake and CO2/N2 selectivity.
- The optimal nitrogen content is significant to high CO2 uptake and selectivity.
- Nitrogen doped carbon nanoscrolls interact more strongly with CO2 than N2.
Using molecular dynamics simulations, we demonstrate that one-sided N-doped graphene can self-assemble into one-sided N-doped carbon nanoscrolls (N-CNS) at room temperature. Besides, the one-sided N-CNS shows excellent CO2 uptake and impressive CO2/N2 selectivity, for example, the one-sided N-CNS with 22.2Â wt% nitrogen has an ultra-high CO2 uptake of 18.21Â mmol/g with good CO2/N2 selectivity (â¼63), and one-sided N-CNS with 12.6Â wt% nitrogen possesses a considerable CO2 uptake of 8.70Â mmol/g with excellent CO2/N2 selectivity (â¼163) at 300Â K and 1Â bar. The high CO2 uptake is attributed to the strong interaction between one-sided N-CNS and CO2 molecules and its tunable space. Because one-sided N-CNS has greater interactions with CO2 molecules than N2 molecules, due to the quadrupole moment of CO2 molecules, it shows the impressive selectivity of CO2/N2. One-sided N-CNS with excellent CO2 uptake and impressive CO2/N2 selectivity should be a promising sorbent for selective CO2 capture from flue gas.
One-sided N-CNS processes both excellent CO2 uptake and impressive CO2/N2 selectivity at atmospheric environment, which should be a promising sorbent for selective CO2 capture from flue gas.236
Journal: Journal of CO2 Utilization - Volume 18, March 2017, Pages 275-282