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Molecular Dynamics simulations of glycerol confined in $\gamma$-Al$_2$O$_3$ slit nanopores are used to explain controversial and inconsistent observations reported in the literature regarding the dynamics of viscous fluids in confined…

Soft Condensed Matter · Physics 2020-04-22 Gerardo Campos-Villalobos , Flor R. Siperstein , Carmine D'Agostino , Alessandro Patti

The exceptional physicochemical properties and versatile biological activities of ionic liquids (ILs) have propelled their potential applications in various industries, including pharmaceuticals and green chemistry. However, their…

Soft Condensed Matter · Physics 2024-07-29 J. Gupta , V. K. Sharma , P. Hitaishi , H. Srinivasan , S. Kumar , S. K. Ghosh , S. Mitra

A study of the reinforcement effect of a soft polymer matrix by hard nanometric filler particles is presented. In the main part of this article, the structure of the silica filler in the matrix is studied by Small Angle Neutron Scattering…

Soft Condensed Matter · Physics 2007-05-23 Julian Oberdisse , Abdeslam El Harrak , Geraldine Carrot , Jacques Jestin , Francois Boue

We outline a strategy for quantitatively evaluating the conformational characteristics of self-assembled structures using the techniques of contrast variation small angle neutron scattering. By means of basis function expansion, a case…

Soft Condensed Matter · Physics 2021-10-27 Albert Y. Ho , Guan-Rong Huang , Wei-Ren Chen

The paper presents a comprehensive analysis of elastic properties of polystyrene-based nanocomposites filled with different types of inclusions: small spherical particles (SiO2 and Al2O3), alumosilicates (montmorillonite, halloysite natural…

We study the aggregation of carbon allotrope nanofillers in the matrix of isotactic polypropylene with direct small-angle neutron scattering measurements. With the ATSAS software, we analyzed the data and determined the fractal shape,…

The past decade has witnessed the rapid progress in synthesizing nanoporous organic networks or polymer frameworks for various potential applications. Generally speaking, functionalization of porous networks to add extra properties and…

Materials Science · Physics 2016-10-11 Jian-Ke Sun , Markus Antonietti , Jiayin Yuan

Over the past two decades polymer nanocomposites have received tremendous interest from industry and academia due to their advanced properties comparative to polymer blends. Many computational studies have revealed that the macroscopic…

Materials Science · Physics 2015-04-07 Argyrios Karatrantos

Polyvalent metal melts (gallium, tin, bismuth, etc.) have microscopic structural features, which are detected by neutron and X-ray diffraction and which are absent in simple liquids. Based on neutron and X-ray diffraction data and results…

Soft Condensed Matter · Physics 2020-02-26 Anatolii V. Mokshin , Ramil M. Khusnutdinoff , Bulat N. Galimzyanov , Vadim V. Brazhkin

The structure and interactions of coated silica nanoparticles have been studied in water using molecular dynamics simulations. For 5 nm diameter amorphous silica nanoparticles we studied the effects of varying the chain length and grafting…

Soft Condensed Matter · Physics 2014-05-22 K. Michael Salerno , Ahmed E. Ismail , J. Matthew D. Lane , Gary S. Grest

Using small angle neutron scattering, we conducted a detailed structural study of poly(3-alkylthiophenes) dispersed in deuterated dicholorbenzene. The focus was placed on addressing the influence of spatial arrangement of constituent atoms…

We present a density functional study of Lennard-Jones liquids in contact with a nano-corrugated wall. The corresponding substrate potential is taken to exhibit a repulsive hard core and a van der Waals attraction. The corrugation is…

Statistical Mechanics · Physics 2014-11-24 Swarn Lata Singh , Lothar Schimmele , S. Dietrich

Molecular dynamics simulations have been performed on pure liquid water, aqueous solutions of sodium chloride, and polymer solutions exposed to a strong external electric field with the goal to gain molecular insight into the structural…

Soft Condensed Matter · Physics 2016-08-08 I. Nezbeda , J. Jirsák , F. Moučka , W. R. Smith

The correlations between the segments of a semidilute polymer solution are found to induce correlations in the positions of small particles added to the solution. Small means a diameter much less than the polymer's correlation length. In…

Soft Condensed Matter · Physics 2009-10-30 Richard P. Sear

We previously reported [Naruse, et al. Sci. Rep. 4, 6077, 2014] that the geometrical randomness of disk-shaped silver nanoparticles, which exhibit high reflection at near-infrared wavelengths, serves as the origin of a particle-dependent…

In frameworks of the scaling theory of phase transitions and critical phenomena the quantitative dependence of macroscopic properties on nanostructural parameters in a polymeric material is revealed. The draw ratios at neck and at break are…

Soft Condensed Matter · Physics 2012-10-30 Andrei N. Yakunin

The effect of silica nanoparticles on transient microemulsion networks made of microemulsion droplets and telechelic copolymer molecules in water is studied, as a function of droplet size and concentration, amount of copolymer, and…

Soft Condensed Matter · Physics 2010-12-07 Nicolas Puech , Serge Mora , Ty Phou , Gregoire Porte , Jacques Jestin , Julian Oberdisse

Hard sphere suspensions are well recognized model systems of statistical physics and soft condensed matter. We here investigate the temporal evolution of the immediate environment of nucleating and growing crystals and/or their global scale…

Soft Condensed Matter · Physics 2015-09-02 Richard Beyer , Markus Franke , Hans Joachim Schöpe , Eckhard Bartsch , Thomas Palberg

In the present study we probe the bulk modulus and the structure of concentrated magnetic fluids by Small Angle X-ray Scattering. The electrostatically stabilized nanoparticles experience a repulsive interparticle potential modulated by…

Soft Condensed Matter · Physics 2013-09-26 E. Wandersman , A. Cēbers , E. Dubois , G. Mériguet , A. Robert , R. Perzynski

We demonstrate a remarkable equivalence in structure measured by total X-ray scattering methods between very small metallic nanoparticles and bulk metallic glasses (BMGs), thus connecting two disparate fields, shedding new light on both.…