FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2048452802> ?p ?o ?g. }

• W2048452802 endingPage "203101" @default.
• W2048452802 startingPage "203101" @default.
• W2048452802 abstract "We review the present understanding of the behavior of ions at the air–water and oil–water interfaces. We argue that while the alkali metal cations remain strongly hydrated and are repelled from the hydrophobic surfaces, the anions must be classified into kosmotropes and chaotropes. The kosmotropes remain strongly hydrated in the vicinity of a hydrophobic surface, while the chaotropes lose their hydration shell and can become adsorbed to the interface. The mechanism of adsorption is still a subject of debate. Here, we argue that there are two driving forces for anionic adsorption: the hydrophobic cavitational energy and the interfacial electrostatic surface potential of water. While the cavitational contribution to ionic adsorption is now well accepted, the role of the electrostatic surface potential is much less clear. The difficulty is that even the sign of this potential is a subject of debate, with the ab initio and the classical force field simulations predicting electrostatic surface potentials of opposite sign. In this paper, we will argue that the strong anionic adsorption found in the polarizable force field simulations is the result of the artificial electrostatic surface potential present in the classical water models. We will show that if the adsorption of anions were as large as predicted by the polarizable force field simulations, the excess surface tension of the NaI solution would be strongly negative, contrary to the experimental measurements. While the large polarizability of heavy halides is a fundamental property and must be included in realistic modeling of the electrolyte solutions, we argue that the point charge water models, studied so far, are incompatible with the polarizable ionic force fields when the translational symmetry is broken. The goal for the future should be the development of water models with very low electrostatic surface potential. We believe that such water models will be compatible with the polarizable force fields, which can then be used to study the interaction of ions with hydrophobic surfaces and proteins." @default.
• W2048452802 created "2016-06-24" @default.
• W2048452802 creator A5044489284 @default.
• W2048452802 creator A5061400232 @default.
• W2048452802 date "2014-04-25" @default.
• W2048452802 modified "2023-09-23" @default.
• W2048452802 title "Ions at hydrophobic interfaces" @default.
• W2048452802 cites W1494690047 @default.
• W2048452802 cites W1571744663 @default.
• W2048452802 cites W1576668315 @default.
• W2048452802 cites W1605936672 @default.
• W2048452802 cites W1964535522 @default.
• W2048452802 cites W1971672113 @default.
• W2048452802 cites W1972175237 @default.
• W2048452802 cites W1973146329 @default.
• W2048452802 cites W1973257472 @default.
• W2048452802 cites W1974021330 @default.
• W2048452802 cites W1974049961 @default.
• W2048452802 cites W1978544368 @default.
• W2048452802 cites W1985248660 @default.
• W2048452802 cites W1987641587 @default.
• W2048452802 cites W1990648127 @default.
• W2048452802 cites W1992438536 @default.
• W2048452802 cites W1994468670 @default.
• W2048452802 cites W1995480689 @default.
• W2048452802 cites W1995968473 @default.
• W2048452802 cites W1996009737 @default.
• W2048452802 cites W2002224144 @default.
• W2048452802 cites W2002236155 @default.
• W2048452802 cites W2003494090 @default.
• W2048452802 cites W2004089129 @default.
• W2048452802 cites W2004999448 @default.
• W2048452802 cites W2005247598 @default.
• W2048452802 cites W2010007880 @default.
• W2048452802 cites W2011062614 @default.
• W2048452802 cites W2012175251 @default.
• W2048452802 cites W2014395371 @default.
• W2048452802 cites W2014485827 @default.
• W2048452802 cites W2016811530 @default.
• W2048452802 cites W2019882487 @default.
• W2048452802 cites W2020964987 @default.
• W2048452802 cites W2022326440 @default.
• W2048452802 cites W2023391815 @default.
• W2048452802 cites W2025524789 @default.
• W2048452802 cites W2025655630 @default.
• W2048452802 cites W2026124230 @default.
• W2048452802 cites W2033668358 @default.
• W2048452802 cites W2044828571 @default.
• W2048452802 cites W2046024650 @default.
• W2048452802 cites W2046078275 @default.
• W2048452802 cites W2049061116 @default.
• W2048452802 cites W2051844996 @default.
• W2048452802 cites W2052548578 @default.
• W2048452802 cites W2054613133 @default.
• W2048452802 cites W2058560683 @default.
• W2048452802 cites W2062654221 @default.
• W2048452802 cites W2062715262 @default.
• W2048452802 cites W2063601288 @default.
• W2048452802 cites W2066160172 @default.
• W2048452802 cites W2068027202 @default.
• W2048452802 cites W2070260018 @default.
• W2048452802 cites W2075320109 @default.
• W2048452802 cites W2076386997 @default.
• W2048452802 cites W2077251768 @default.
• W2048452802 cites W2081681492 @default.
• W2048452802 cites W2082853624 @default.
• W2048452802 cites W2083092800 @default.
• W2048452802 cites W2083407560 @default.
• W2048452802 cites W2085112874 @default.
• W2048452802 cites W2085881993 @default.
• W2048452802 cites W2086930869 @default.
• W2048452802 cites W2087243552 @default.
• W2048452802 cites W2088960562 @default.
• W2048452802 cites W2089260408 @default.
• W2048452802 cites W2093677418 @default.
• W2048452802 cites W2095112507 @default.
• W2048452802 cites W2101185848 @default.
• W2048452802 cites W2103065014 @default.
• W2048452802 cites W2108285714 @default.
• W2048452802 cites W2109920390 @default.
• W2048452802 cites W2116017678 @default.
• W2048452802 cites W2117456169 @default.
• W2048452802 cites W2126276771 @default.
• W2048452802 cites W2127400370 @default.
• W2048452802 cites W2137629913 @default.
• W2048452802 cites W2152977647 @default.
• W2048452802 cites W2156963746 @default.
• W2048452802 cites W2164699343 @default.
• W2048452802 cites W2165357882 @default.
• W2048452802 cites W2313765073 @default.
• W2048452802 cites W2319397042 @default.
• W2048452802 cites W2324824843 @default.
• W2048452802 cites W2330662234 @default.
• W2048452802 cites W2330938767 @default.
• W2048452802 cites W2335467672 @default.
• W2048452802 cites W2335599104 @default.
• W2048452802 cites W2963596279 @default.
• W2048452802 cites W2978641146 @default.

• next