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It is found out that there are physical effects, typical of small metal clusters deposited on a non-adsorbing support, that cause a difference between the adsorption properties of sites at the metal cluster surface and those of sites at the…

Statistical Mechanics · Physics 2007-05-23 Maria K. Koleva , L. A. Petrov

Many ionic surfactants, such as sodium dodecyl sulphate (SDS) crystallize out of solution if the temperature falls below the crystallization boundary. The crystallization temperature is impacted by solution properties, and can be decreased…

The forces of electrical imaging strongly polarize the surface of colloidal silica. I used X-ray scattering to study the adsorbed 2-nm-thick compact layer of alkali ions at the surface of concentrated solutions of 5-nm, 7-nm, and 22-nm…

Soft Condensed Matter · Physics 2007-05-23 Aleksey M. Tikhonov

Rates of aggregation of dodecane-in-water (d/w) nanoemulsions stabilized with 7.5 mM sodium dodecylsulfate (SDS) are evaluated beyond 500 mM NaCl. As in the case of hexadecane-in-water (h/w) emulsions, it is found that flocculation rates…

Soft Condensed Matter · Physics 2020-07-15 Daniela Diaz , Kareem Rahn-Chique , Neyda Garcia-Valera , German Urbina-Villalba

A theory is presented which quantitatively accounts for the cooperative adsorption of cationic surfactants to anionic polyelectrolytes. For high salt concentration we find that the critical adsorption concentration (CAC) is a bilinear…

Soft Condensed Matter · Physics 2009-11-13 Paulo S. Kuhn , Yan Levin , Marcia C. Barbosa , Ana Paula Ravazzolo

The adsorption of polymer and surfactant molecules onto colloidal particles or droplets in solution can be characterized non-destructively by scattering techniques. In a first part, the general framework of Dynamic Light Scattering, Small…

Soft Condensed Matter · Physics 2007-05-24 Julian Oberdisse

We present theory and simulations which allow us to quantitatively calculate the amount of surface adsorption excess of charged nanoparticles onto a charged surface. The theory is very accurate for weakly charged nanoparticles and can be…

Soft Condensed Matter · Physics 2018-01-24 Alexandre P. dos Santos , Amin Bakhshandeh , Alexandre Diehl , Yan Levin

The hydrogen adsorption sites in MOF5 were determined using neutron powder diffraction along with first-principles calculations. The metal-oxide cluster is primarily responsible for the adsorption while the organic linker plays only a…

Materials Science · Physics 2009-11-11 T. Yildirim , M. R. Hartman

The adsorption of ethylene molecule on neutral, anionic and cationic gold clusters consisting of up to 10 atoms has been investigated using density-functional theory. It is demonstrated that C2H4 can be adsorbed on small gold clusters in…

Atomic and Molecular Clusters · Physics 2011-03-02 Andrey Lyalin , Tetsuya Taketsugu

The selective adsorption of a corrosive gas, SO$_2$, into two microporous pillared paddle-wheel frameworks M(bdc)(ted)0.5 [M = Ni, Zn; bdc = 1,4-benzenedicarboxylate; ted = triethylenediamine] is studied by volumetric adsorption…

We study the behavior of aqueous surfactant solutions in the bulk phase and in slit-like pores by molecular dynamics. Adsorption and self-assembly of nonionic surfactants C$_7$E$_3$ that mimic alkyl poly(ethylene oxide) molecules are…

Soft Condensed Matter · Physics 2026-03-31 T. Staszewski , M. Borówko

Understanding interfacial phenomena in confined systems is important for optimizing CO2 capture technologies. Here, we present a comprehensive investigation of CO2 adsorption in hydrated amorphous silica nanopores through an integrated…

Materials Science · Physics 2025-02-12 Jihong Shi , Tao Zhang , Shuyu Sun , Liang Gong

The dissociative adsorption of methane on variously oxidized Pd, Pt and Pd-Pt surfaces is investigated using density-functional theory, as a step towards understanding the combustion of methane on these materials. For Pd-Pt alloys, models…

The success of density functional theory for the description of the adsorption of atoms on surfaces is well established, and based on recent calculations using gradient corrections, it has been shown that it also describes well the…

mtrl-th · Physics 2008-02-03 Catherine Stampfl

We present chemical abundance measurements from high-resolution observations of 5 sub-damped Lyman-alpha absorbers at 1.7 < z < 2.4 observed with the Magellan Inamori Kyocera Echelle (MIKE) spectrograph on the 6.5-m Magellan II Clay…

Cosmology and Nongalactic Astrophysics · Physics 2013-07-29 Debopam Som , Varsha P. Kulkarni , Joseph Meiring , Donald G. York , Celine Péroux , Pushpa Khare , James T. Lauroesch

This study explores atomic and molecular adsorption on a number of early transition-metal carbides (TMC's) by means of density-functional theory calculations. Trend studies are conducted with respect to both period and group in the periodic…

Materials Science · Physics 2012-05-14 Aleksandra Vojvodic , Carlo Ruberto , Bengt I. Lundqvist

The adsorption of atomic oxygen and its inclusion into subsurface sites on Ag(210) and Ag(410) surfaces have been investigated using density functional theory. We find that--in the absence of adatoms on the first metal layer--subsurface…

Condensed Matter · Physics 2009-11-10 A. Kokalj , N. Bonini , A. Dal Corso , S. de Gironcoli , S. Baroni

The adsorption of Ag$_3$ and Ag$_4$ clusters on the $\alpha$-Al$_2$O$_3$(0001) surface is explored with density functional theory. Within each adsorbed cluster, two different cluster-surface interactions are present. We find that silver…

Materials Science · Physics 2007-05-23 Elizabeth A. Sokol , Sara E. Mason , Valentino R. Cooper , Andrew M. Rappe

The molecular mechanisms by which organic additives such as saccharin control microstructure in nickel electrodeposition remain inadequately understood, particularly the role of the intense interfacial electric field. This study employs…

Materials Science · Physics 2025-12-23 Aylar G. M. Ghashghaei , Mahboubeh Khorrami , Mohammad Ebrahim Bahrololoom

The metal line profiles of different ions observed in high HI column density systems [N(HI) > 10^{16} cm^{-2}] in quasar spectra can be used to constrain the ionization structure and kinematic characteristics of the absorbers. For these…

Astrophysics · Physics 2009-11-07 S. A. Levshakov , I. I. Agafonova , M. Centurion , I. E. Mazets