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| Dynamics of Evaporation from Confined Water in an SWCNT in the Presence of an External Field | |
| Li, JX; Li, WF; Fang, HP; Zhang, JW; Zhang, JW (reprint author), Tongji Univ, Shanghai Key Lab Special Artificial Microstruct, Sch Phys Sci & Engn, Shanghai 200092, Peoples R China. | |
| 2016 | |
| Source Publication | JOURNAL OF PHYSICAL CHEMISTRY C
 |
| ISSN | 1932-7447 |
| Volume | 120Issue:12Pages:6493—6501 |
| Subtype | 期刊文献 |
| Abstract | The dynamics of evaporation of water molecules from a single-walled carbon nanotube were investigated by molecular dynamics simulations. A single barrier macro-statistical model was proposed to account for the interactions between water molecules and the single-walled carbon nanotube. Besides, the study found that the cumulative probability of water escaping from the nanotube exhibits the Maxwell-Boltzmann distribution, and thus the energy barrier for water spillage from the carbon tube could be evaluated. Meanwhile, on the basis of our quantitative analysis, the blocking temperature for typical measure time and the specified escape barrier could thereby be found. Furthermore, through the statistical analysis, several interesting phenomena could be found in the dynamical processes of water confined in the nanotubes. The procedure to extract barrier information may be useful for the analysis of experiments on water transport within confined systems. |
| Keyword | Walled Carbon Nanotubes Transport Kinetics Desalination Simulations Transition Nanopipes Channel Model Flow |
| DOI | 10.1021/acs.jpcc.5b11040 |
| Indexed By | SCI |
| Language | 英语 |
| WOS ID | WOS:000373416500024 |
| Citation statistics | |
| Document Type | 期刊论文 |
| Identifier | http://ir.sinap.ac.cn/handle/331007/25692 |
| Collection | 中科院上海应用物理研究所2011-2018年 |
| Corresponding Author | Zhang, JW (reprint author), Tongji Univ, Shanghai Key Lab Special Artificial Microstruct, Sch Phys Sci & Engn, Shanghai 200092, Peoples R China. |
| Recommended Citation GB/T 7714 | Li, JX,Li, WF,Fang, HP,et al. Dynamics of Evaporation from Confined Water in an SWCNT in the Presence of an External Field[J]. JOURNAL OF PHYSICAL CHEMISTRY C,2016,120(12):6493—6501. |
| APA | Li, JX,Li, WF,Fang, HP,Zhang, JW,&Zhang, JW .(2016).Dynamics of Evaporation from Confined Water in an SWCNT in the Presence of an External Field.JOURNAL OF PHYSICAL CHEMISTRY C,120(12),6493—6501. |
| MLA | Li, JX,et al."Dynamics of Evaporation from Confined Water in an SWCNT in the Presence of an External Field".JOURNAL OF PHYSICAL CHEMISTRY C 120.12(2016):6493—6501. |
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| File Name/Size | DocType | Version | Access | License | ||
| Dynamics of Evaporat（2956KB） | 期刊论文 | 作者接受稿 | 开放获取 | CC BY-NC-SA | View Download | |
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