Sharing of Na+ by Three -COO- Groups at Deprotonated Carboxyl-Terminated Self-Assembled Monolayer-Charged Aqueous Interface | |
Liu, X; Huang, G; Hu, KK; Sheng, N; Tian, CS; Shen, YR; Wen, YC; Shi, GS; Fang, HP | |
刊名 | JOURNAL OF PHYSICAL CHEMISTRY C
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2018 | |
卷号 | 122期号:16页码:9111-9116 |
关键词 | Sum-frequency Generation Space Gaussian Pseudopotentials Molecular-dynamics Simulation X-ray-absorption Hofmeister Series Water Orientation Spectroscopy Ion Potentials Binding |
ISSN号 | 1932-7447 |
DOI | 10.1021/acs.jpcc.8b02065 |
文献子类 | 期刊论文 |
英文摘要 | By combining theoretical calculations and experimental observations, we show that Na+ can be shared by three charged -COO- groups of the deprotonated carboxyl-terminated self-assembled mono layers in aqueous solution at lipid-aqueous interface. This is similar to the sharing structure of Na+ usually found in crystals. Notably, this ionic configuration leads to a hydroxyl orientation distribution of interfacial water molecules, showing a maximum toward the bulk solution, in addition to the maximum toward the charged surface expected based on the structure of one-to-one ion-pair formation between Na+ and -COO-. Our results provide new insights for a better understanding of electrochemically and biologically related charged interfaces at the molecular level and should be helpful to design the nanodevices and bioinspired human-made nanomaterials. |
语种 | 英语 |
WOS记录号 | WOS:000431151200046 |
内容类型 | 期刊论文 |
源URL | [http://ir.sinap.ac.cn/handle/331007/29134] ![]() |
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.Liu, X 2.Huang, G 3.Hu, KK 4.Sheng, N 5.Tian, CS 6.Shen, YR 7.Wen, YC 8.Shi, GS 9.Fang, HP |
推荐引用方式 GB/T 7714 | Liu, X,Huang, G,Hu, KK,et al. Sharing of Na+ by Three -COO- Groups at Deprotonated Carboxyl-Terminated Self-Assembled Monolayer-Charged Aqueous Interface[J]. JOURNAL OF PHYSICAL CHEMISTRY C,2018,122(16):9111-9116. |
APA | Liu, X.,Huang, G.,Hu, KK.,Sheng, N.,Tian, CS.,...&Fang, HP.(2018).Sharing of Na+ by Three -COO- Groups at Deprotonated Carboxyl-Terminated Self-Assembled Monolayer-Charged Aqueous Interface.JOURNAL OF PHYSICAL CHEMISTRY C,122(16),9111-9116. |
MLA | Liu, X,et al."Sharing of Na+ by Three -COO- Groups at Deprotonated Carboxyl-Terminated Self-Assembled Monolayer-Charged Aqueous Interface".JOURNAL OF PHYSICAL CHEMISTRY C 122.16(2018):9111-9116. |
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