Literature DB >> 22404593

Progress in modeling of ion effects at the vapor/water interface.

Roland R Netz1, Dominik Horinek.   

Abstract

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.

Entities:  

Year:  2012        PMID: 22404593     DOI: 10.1146/annurev-physchem-032511-143813

Source DB:  PubMed          Journal:  Annu Rev Phys Chem        ISSN: 0066-426X            Impact factor:   12.703


  13 in total

1.  Image-charge effects on ion adsorption near aqueous interfaces.

Authors:  Chang Yun Son; Zhen-Gang Wang
Journal:  Proc Natl Acad Sci U S A       Date:  2021-05-11       Impact factor: 11.205

2.  Free energetics of carbon nanotube association in aqueous inorganic NaI salt solutions: Temperature effects using all-atom molecular dynamics simulations.

Authors:  Shu-Ching Ou; Di Cui; Matthew Wezowicz; Michela Taufer; Sandeep Patel
Journal:  J Comput Chem       Date:  2015-04-13       Impact factor: 3.376

3.  Association of alkanes with the aqueous liquid-vapor interface: a reference system for interpreting hydrophobicity generally through interfacial fluctuations.

Authors:  Shu-Ching Ou; Di Cui; Sandeep Patel
Journal:  Phys Chem Chem Phys       Date:  2014-12-28       Impact factor: 3.676

Review 4.  Computer Simulation of the Surface of Aqueous Ionic and Surfactant Solutions.

Authors:  Mária Lbadaoui-Darvas; Abdenacer Idrissi; Pál Jedlovszky
Journal:  J Phys Chem B       Date:  2021-12-14       Impact factor: 3.466

5.  Temperature dependence and energetics of single ions at the aqueous liquid-vapor interface.

Authors:  Shuching Ou; Sandeep Patel
Journal:  J Phys Chem B       Date:  2013-05-17       Impact factor: 2.991

6.  Rational Design of Particle Mesh Ewald Compatible Lennard-Jones Parameters for +2 Metal Cations in Explicit Solvent.

Authors:  Pengfei Li; Benjamin P Roberts; Dhruva K Chakravorty; Kenneth M Merz
Journal:  J Chem Theory Comput       Date:  2013-06-11       Impact factor: 6.006

7.  Influence of specific anions on the orientational ordering of thermotropic liquid crystals at aqueous interfaces.

Authors:  Rebecca J Carlton; C Derek Ma; Jugal K Gupta; Nicholas L Abbott
Journal:  Langmuir       Date:  2012-08-21       Impact factor: 3.882

8.  Spherical monovalent ions at aqueous liquid-vapor interfaces: interfacial stability and induced interface fluctuations.

Authors:  Shuching Ou; Yuan Hu; Sandeep Patel; Hongbin Wan
Journal:  J Phys Chem B       Date:  2013-09-16       Impact factor: 2.991

9.  Water-mediated ion-ion interactions are enhanced at the water vapor-liquid interface.

Authors:  Vasudevan Venkateshwaran; Srivathsan Vembanur; Shekhar Garde
Journal:  Proc Natl Acad Sci U S A       Date:  2014-06-02       Impact factor: 11.205

10.  Assessing long-range contributions to the charge asymmetry of ion adsorption at the air-water interface.

Authors:  Stephen J Cox; Dayton G Thorpe; Patrick R Shaffer; Phillip L Geissler
Journal:  Chem Sci       Date:  2020-10-05       Impact factor: 9.825

View more

北京卡尤迪生物科技股份有限公司 © 2022-2023.