Progress in Modeling of Ion Effects at the Vapor/Water Interface

被引：108
|
作者：
Netz, Roland R. [1 ]
Horinek, Dominik [2 ]
机构：
[1] Free Univ Berlin, Fachbereich Phys, D-14195 Berlin, Germany
[2] Univ Regensburg, Inst Phys & Theoret Chem, D-93040 Regensburg, Germany
来源：
ANNUAL REVIEW OF PHYSICAL CHEMISTRY, VOL 63 | 2012年 / 63卷
关键词：
Hofmeister effects; surface tension; molecular simulations; force fields; MOLECULAR-DYNAMICS SIMULATIONS; SURFACE-TENSION; FREE-ENERGY; AQUEOUS-SOLUTIONS; VIBRATIONAL SPECTROSCOPY; LIQUID INTERFACE; FORCE-FIELD; WATER; HYDRATION; SOLVATION;
D O I：
10.1146/annurev-physchem-032511-143813
中图分类号：
O64 [物理化学（理论化学）、化学物理学];
学科分类号：
070304 ; 081704 ;
摘要：
The behavior of halide salts at the vapor/water interface has been the focus of a tremendous amount of work in the past ten years. A molecular view of the interface has been introduced with the observation that large anions have some affinity for the interface, but a quantitative description of the driving forces that determine ion adsorption or repulsion at the interface is still missing. This review discusses recent developments that are based on classical and quantum-chemical molecular simulations as well as developments that are based on simple potential models.
引用
收藏
页码：401 / 418
页数：18
相关论文
共 50 条
  • [21] Affinity of Hydrated Protons at Intrinsic Water/Vapor Interface Revealed by Ion-Induced Water Alignment
    Chiang, Kuo-Yang
    Dalstein, Laetitia
    Wen, Yu-Chieh
    JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2020, 11 (03): : 696 - 701
  • [22] Does the water surface potential play a role in ion segregation to the water liquid-vapor interface?
    Beck, Thomas L.
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2012, 244
  • [23] Modeling ion distribution at the membrane/water interface using a lattice of dipoles
    Sachs, JN
    Grossfield, A
    Woolf, TB
    BIOPHYSICAL JOURNAL, 2001, 80 (01) : 423A - 423A
  • [24] Water Vapor Cooling Effects in Turning by Finite Element Modeling
    Yang, Fan
    Huang, Jianlong
    MANUFACTURING PROCESS TECHNOLOGY, PTS 1-5, 2011, 189-193 : 1631 - 1634
  • [25] The influence of concentration on specific ion effects at the silica/water interface
    Azam, Md Shafiul
    Darlington, Akemi
    Gibbs-Davis, Julianne M.
    JOURNAL OF PHYSICS-CONDENSED MATTER, 2014, 26 (24)
  • [26] Ions at the Water-Vapor Interface
    Tamashiro, M. N.
    Constantino, M. A.
    JOURNAL OF PHYSICAL CHEMISTRY B, 2010, 114 (10): : 3583 - 3591
  • [27] Adsorption of trichloroethene at the vapor/water interface
    Bruant, RG
    Conklin, MH
    ENVIRONMENTAL SCIENCE & TECHNOLOGY, 2001, 35 (02) : 362 - 364
  • [28] Behavior of hydroxide at the water/vapor interface
    Winter, Bernd
    Faubel, Manfred
    Vacha, Robert
    Jungwirth, Pavel
    CHEMICAL PHYSICS LETTERS, 2009, 474 (4-6) : 241 - 247
  • [29] Adsorption of hexane at the water/vapor interface
    Lou, AJ
    Pethica, BA
    LANGMUIR, 1997, 13 (19) : 4933 - 4934
  • [30] On the uptake of ammonia by the water/vapor interface
    Carignano, M. A.
    Jacob, M. M.
    Avila, E. E.
    JOURNAL OF PHYSICAL CHEMISTRY A, 2008, 112 (16): : 3676 - 3679
12345