Effect of confinement on water rotation via quantum tunnelling
文献类型：期刊论文
| 作者 | Zhang, DP; Zhang, ZY; Jiang, WR; Gao, Y; Wang, ZG |
| 刊名 | NANOSCALE
 |
| 出版日期 | 2018 |
| 卷号 | 10期号:39页码:18622-18626 |
| 关键词 | HYDROGEN-BOND CARBON NANOTUBES LIQUID WATER DIMER SPECTROSCOPY |
| ISSN号 | 2040-3364 |
| DOI | 10.1039/c8nr05137b |
| 文献子类 | 期刊论文 |
| 英文摘要 | Water exhibits different behaviors in confined space compared to free space, which is critical for desalination, biosensing, and many potential applications. Recent studies indicated that quantum tunnelling plays an important role in the orientation of H2O molecules and the H-bond network of water clusters, but whether this effect is important in confined space remains elusive. Here, we studied the quantum tunnelling effect of water dimers in carbon nanotubes with different sizes by first-principles calculations. Our results show that though this effect may be negligible at room temperature, it becomes dominant at low temperatures up to similar to 100 Kelvin. In particular, with the injection of a small amount of energy to excite a specific vibrational mode, the tunnelling rotation effect can be significantly enhanced, which provides a new strategy to tune the H-bond network of confined water. |
| 语种 | 英语 |
| 源URL | [http://ir.sinap.ac.cn/handle/331007/30913]  |
| 专题 | 上海应用物理研究所_中科院上海应用物理研究所2011-2017年 |
| 作者单位 | 1.Jilin Univ, Jilin Prov Key Lab Appl Atom & Mol Spect, Changchun 130012, Jilin, Peoples R China 2.Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai 201800, Peoples R China 3.Jilin Univ, Inst Atom & Mol Phys, Changchun 130012, Jilin, Peoples R China |
| 推荐引用方式 GB/T 7714 | Zhang, DP,Zhang, ZY,Jiang, WR,et al. Effect of confinement on water rotation via quantum tunnelling[J]. NANOSCALE,2018,10(39):18622-18626. |
| APA | Zhang, DP,Zhang, ZY,Jiang, WR,Gao, Y,&Wang, ZG.(2018).Effect of confinement on water rotation via quantum tunnelling.NANOSCALE,10(39),18622-18626. |
| MLA | Zhang, DP,et al."Effect of confinement on water rotation via quantum tunnelling".NANOSCALE 10.39(2018):18622-18626. |
入库方式： OAI收割
来源：上海应用物理研究所
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