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We investigate the properties of water along the liquid/vapor coexistence line in the supercooled regime down to the no-man's land. Extensive molecular dynamics simulations of the TIP4P/2005 liquid/vapor interface in the range 198 -- 348 K…

软凝聚态物质 · 物理学 2023-02-15 Alexander Gorfer , Christoph Dellago , Marcello Sega

We study the interaction between heterogeneously charged surfaces in an electrolyte solution by employing classical Density Functional Theory (cDFT) and Monte Carlo simulations. We observe a consistent behavior between cDFT and Monte Carlo…

软凝聚态物质 · 物理学 2023-07-11 Shiqi Zhou , Amin Bakhshandeh

The interaction between two adjacent charged surfaces immersed in aqueous solution is known to be affected by charge regulation - the modulation of surface charge as two charged surfaces approach each other. This phenomenon is particularly…

软凝聚态物质 · 物理学 2022-07-26 Tal Obstbaum , Uri Sivan

Presented here is a description of the ionization of hydrogen and hydrogenic ions by antiproton-impact, based on very large scale numerical solutions of the time-dependent Schr\"odinger equation in three spatial dimensions and on analysis…

atom-ph · 物理学 2009-10-28 D. R. Schultz , P. S. Krstic , C. O. Reinhold , J. C. Wells

The equilibrium contact angle of a droplet resting on a solid substrate can reveal essential properties of the solid's surface. However, when the motion of a droplet on a surface shows significant hysteresis, it is generally accepted that…

软凝聚态物质 · 物理学 2021-07-14 Jin Young Kim , Stefanie Heyden , Dominic Gerber , Nicolas Bain , Eric R. Dufresne , Robert W. Style

Anion exchange at positively charged interfaces plays an important role in a variety of physical and chemical processes. However, the molecular scale details of these processes, especially with heavy and large anionic complexes, are not…

软凝聚态物质 · 物理学 2017-12-06 Ahmet Uysal , William Rock , Baofu Qiao , Wei Bu , Binhua Lin

We show that the surface tension of fluid near the critical point may be correctly described by taking into consideration the microscopic structure of the system using a {\phi}4 field theory. We revise the theory of the surface tension near…

统计力学 · 物理学 2020-07-01 A. R. Dzhanoev , I. M. Sokolov

There is mounting evidence indicating that relaxation dynamics in liquids approaching their glass transition not only becomes increasingly cooperative (1,2) but the relaxing regions also become more compact in shape(3-7). While the surface…

统计力学 · 物理学 2018-02-21 Divya Ganapathi , Hima K Nagamanasa , A. K. Sood , Rajesh Ganapathy

The early stages of high energy heavy ion collisions are studied in the Color Glass Condensate framework, with a real-time classical lattice simulation. When increasing the coupling constant, we observe a rapid increase of the ratio of…

高能物理 - 唯象学 · 物理学 2013-12-16 Thomas Epelbaum , Francois Gelis

Whether or not specific ion effects determine the charge storage properties of aqueous graphene and graphite-based supercapacitors remains a highly debated topic. In this work we present a multiscale quantum mechanics classical molecular…

材料科学 · 物理学 2022-11-10 Joshua D. Elliott , Mara Chiricotto , Alessandro Troisi , Paola Carbone

The adsorption of mixtures of poly(diallyldimethylammonium chloride) (PDADMAC) and sodium N-lauroyl-N-methyltaurate (SLMT) at the water / vapor interface has been studied using drop profile tensiometry and neutron reflectometry. This study…

We study macroion adsorption on planar surfaces, through a simple model. The importance of entropy in the interfacial phenomena is stressed. Our results are in qualitative agreement with available computer simulations and experimental…

软凝聚态物质 · 物理学 2007-05-23 Felipe Jimenez-Angeles , Marcelo Lozada-Cassou

In this communication we show that the surface tension of the real fluids of the Lennard-Jones type can be obtained from the surface tension of the lattice gas (Ising model) on the basis of the global isomorphism approach developed earlier…

统计力学 · 物理学 2018-12-24 Vladimir Kulinskii

The results of molecular dynamics simulations of the properties of water in an aqueous ionic solution close to an interface with a model metallic electrode are described. In the simulations the electrode behaves as an ideally polarizable…

统计力学 · 物理学 2014-09-09 Adam P. Willard , Stewart K. Reed , Paul A. Madden , David Chandler

We calculate the interaction potential between two colloids immersed in an aqueous mixture containing salt near or above the critical temperature. We find an attractive interaction far from the coexistence curve due to the combination of…

软凝聚态物质 · 物理学 2015-06-03 Sela Samin , Yoav Tsori

Thermo-osmotic flows, generated at liquid-solid interfaces by thermal gradients, can be used to produce electric currents from waste heat on charged surfaces. The two key parameters controlling the thermo-osmotic current are the surface…

软凝聚态物质 · 物理学 2024-03-19 Mehdi Ouadfel , Michael De San Féliciano , Cecilia Herrero , Samy Merabia , Laurent Joly

Spatial interaction effects between charge carriers in ionic systems play a sizable role beyond a classical Maxwellian description. We develop a nonlocal, two-fluid, hydrodynamic theory of charges and study ionic plasmon effects, i. e.…

光学 · 物理学 2020-06-30 Christin David

Anions generally associate more favorably with the air-water interface than cations. In addition to solute size and polarizability, the intrinsic structure of the unperturbed interface has been discussed as an important contributor to this…

软凝聚态物质 · 物理学 2021-03-25 Stephen J. Cox , Dayton G. Thorpe , Patrick R. Shaffer , Phillip L. Geissler

In this tutorial we discuss the chemical potential of ions in water (i.e., in a salt solution, in an electrolyte phase) and inside (charged) nanoporous materials such as porous membranes. In water treatment, such membranes are often used to…

化学物理 · 物理学 2025-06-25 P. M. Biesheuvel

Soft particles display highly versatile properties with respect to hard colloids, even more so at fluid-fluid interfaces. In particular, microgels, consisting of a cross-linked polymer network, are able to deform and flatten upon adsorption…

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