首页> 外文OA文献 >Long Distance Correlations in Molecular Orientations of Liquid Water and Shape Dependant Hydrophobic Force

【2h】

Long Distance Correlations in Molecular Orientations of Liquid Water and Shape Dependant Hydrophobic Force

机译：液态水和水的分子取向的长距离相关性形状依赖的疏水力

代理获取

本网站仅为用户提供外文OA文献查询和代理获取服务，本网站没有原文。下单后我们将采用程序或人工为您竭诚获取高质量的原文，但由于OA文献来源多样且变更频繁，仍可能出现获取不到、文献不完整或与标题不符等情况，如果获取不到我们将提供退款服务。请知悉。

页面导航

摘要
著录项
相似文献
相关主题

摘要

Liquid water, at ambient conditions, has short-range density correlationswhich are well known in literature. Surprisingly, large scale moleculardynamics simulations reveal an unusually long-distance correlation in`longitudinal' part of dipole-dipole orientational correlations. It isnon-vanishing even at 75 \AA{} and falls-off exponentially with a correlationlength of about 24 \AA{} beyond solvation region. Numerical evidence suggeststhat the long range nature of dipole-dipole correlation is due to underlyingfluctuating network of hydrogen-bonds in the liquid phase. This correlation isshown to give a shape dependant attraction between two hydrophobic surfaces atlarge distances of separation and the range of this attractive force is inagreement with experiments. In addition it is seen that quadrupolarfluctuations vanish within the first solvation peak (3 \AA{})

机译：在环境条件下，液态水具有短程密度相关性，这在文献中是众所周知的。出乎意料的是，大规模分子动力学模拟揭示了偶极-偶极取向相关性的“纵向”部分中异常长距离的相关性。即使在75 \ AA {}时，它也不会消失，并且在溶剂化区域以外以约24 \ AA {}的相关长度呈指数下降。数值证据表明，偶极子-偶极子相关性的长距离性质是由于液相中氢键的潜在波动网络所致。该相关性显示出在较大的分离距离下在两个疏水性表面之间提供了形状依赖性的吸引力，并且该吸引力的范围与实验不一致。此外，可以看到在第一个溶剂化峰（3 \ AA {}）内四极波动消失了

著录项

作者
Kanth, J. M. Pradeep; Vemparala, Satyavani; Anishetty, Ramesh;
展开▼
作者单位

展开▼
年度 2009
总页数
原文格式 PDF
正文语种
中图分类

相似文献

外文文献
中文文献
专利

1. Nanometer range correlations between molecular orientations in liquidsof molecules with perfect tetrahedral shape: CCI_4, SiCI_4, GeCI_4,and SnCI_4 [J] . Sz. Pothoczki, L.Temleitner, P. Jovari, The Journal of Chemical Physics . 2009,第6期

机译：具有完美四面体形状的分子的液体中的分子取向之间的纳米范围相关性：CCI_4，SiCI_4，GeCI_4和SnCI_4
2. Correlation between hydrophobic and molecular shape descriptors and retention data of polycyclic aromatic hydrocarbons in reversed-phase chromatography on non-liquid-crystalline, nematic, and smectic stationary phases [J] . Gritti F., Sourigues S., Felix G., Chromatographia . 2002,第3a4期

机译：非液晶，向列和近晶固定相反相色谱中疏水性和分子形状描述符与多环芳烃保留数据的相关性
3. Correlation between hydrophobic and molecular shape descriptors and retention data of polycyclic aromatic hydrocarbons in reversed-phase chromatography on non-liquid-crystalline, nematic, and smetic stationary phases [J] . F. Gritti, S. Sourigues, G. Félix, Chromatographia . 2002,第3a4期

机译：非液晶，向列和密相固定相上反相色谱中疏水性和分子形状描述符与多环芳烃保留数据的相关性
4. The interfacial behavior of liquid water near hydrophobic surfaces: a parallel force decomposition molecular dynamics code [C] . Paul M. Alsing, Evangelos Coutsias, John McIver Sixth International Conference on Applications of High-Performance Computing in Engineering, 6th . 2000

机译：疏水表面附近液态水的界面行为：平行力分解分子动力学代码
5. STATISTICAL MECHANICAL STUDIES OF MOLECULAR SOLVATION (HYDROPHOBIC HYDRATION, LIQUID THEORY, MOLECULAR DYNAMICS). [D] . ZICHI, DOMINIC ANTHONY. 1985

机译：分子溶剂化的统计力学研究（疏水性水合，液体理论，分子动力学）。
6. Liquids and Structural Glasses Special Feature: Characterizing hydrophobicity of interfaces by using cavity formation solute binding and water correlations [O] . Rahul Godawat, Sumanth N. Jamadagni, Shekhar Garde 2009

机译：液体和结构玻璃的特殊功能：利用空穴形成溶质结合和水相关性来表征界面的疏水性
7. Local orientational correlations and short time anisotropic motion in molecular liquids: Computer simulations of liquid CO2 [O] . I. I. Fedchenia, J. Schröder 1997

机译：分子液体局部取向相关性和短时间各向异性运动：液体二氧化碳的计算机模拟

Long Distance Correlations in Molecular Orientations of Liquid Water and Shape Dependant Hydrophobic Force

摘要

著录项

相似文献

相关主题

期刊订阅