Search results for "PLASTICS"

Densely packed semiflexible macromolecules in a rigid spherical capsule

2018

The ordering of semiflexible polymers with persistence length lp and contour length L confined in a sphere of radius R is studied by molecular dynamics simulations of a coarse-grained model. Monomer densities are chosen where the corresponding bulk lyotropic solution or melt is a well-ordered nematic, and purely repulsive walls of the rigid confining sphere are considered. It is found that polymers close to the walls are bent according to the curvature of the confining spheres with all their monomers in a few layers parallel to the sphere surface, whereas the remaining macromolecules closer to the sphere center have one chain end and their center of mass far from the surface. The latter cha…

Hyperbranched poly(glycolide) copolymers with glycerol branching points via ring-opening copolymerization

2015

Abstract Sn(Oct) 2 -catalyzed synthesis of hyperbranched poly(glycolide) copolymers with glycerol branching points in the backbone is possible via ring-opening multi-branching copolymerization (ROMBP) of glycolide and 5HDON (5-hydroxymethyl-1,4-dioxan-2-one). Using this strategy, well-defined and soluble branched polyesters with apparent molecular weights (M n ) in the range of 1300–2000 g mol −1 and varying comonomer content (5HDON/glycolide = 30:70–70:30) were obtained. 2D NMR spectroscopy, thermal analysis and MALDI-TOF mass spectrometry confirmed the successful incorporation of both monomers and the resulting branched structure. Multiple end group functionality offers the possibility fo…

Blends of poly(2,6-dimethyl-1,4-phenylene oxide) with styrene copolymers

1994

Binary blends of poly(2,6–dimethyl–1,4–phenylene oxide) (PPE) with various styrene copolymers were investigated. Poly(styrene–co–acrylonitrile) (SAN), poly[styrene–co–(methyl methacrylate)] (SMMA), poly[styrene–co–(acrylic acid)] (SAA) and poly[styrene–co–(maleic anhydride)] (SMA) are only miscible with PPE when the amount of comonomer is rather small. From calculated binary interaction densities it can be concluded that the strong repulsion between PPE and comonomer limits miscibility. In blends of PPE with SAN, as well as with ABS, the inter-facial tension between the blend components is significantly reduced upon addition of polystyrene–block–poly–(methyl methacrylate) diblock copolymers…

Pinned hybrid glass-flax composite laminates aged in salt-fog environment: Mechanical durability

2019

The aim of the present paper is to study the mechanical performance evolution of pinned hybrid glass-flax composite laminates under environment aging conditions. Hybrid glass-flax fibers/epoxy pinned laminates were exposed to salt-spray fog environmental conditions up to 60 days. With the purpose of assessing the relationship between mechanical performances and failure mechanisms at increasing aging time, single lap joints at varying joint geometry (i.e., hole diameter D and hole distance E from free edge) were characterized after 0 days (i.e., unaged samples), 30 days, and 60 days of salt-fog exposition. Based on this approach, the property&ndash

New concept in bioderived composites: Biochar as toughening agent for improving performances and durability of agave-based epoxy biocomposites

2021

Biocomposites are increasingly used in the industry for the replacement of synthetic materials, thanks to their good mechanical properties, being lightweight, and having low cost. Unfortunately, in several potential fields of structural application their static strength and fatigue life are not high enough. For this reason, several chemical treatments on the fibers have been proposed in literature, although still without fully satisfactory results. To overcome this drawback, in this study we present a procedure based on the addition of a carbonaceous filler to a green epoxy matrix reinforced by Agave sisalana fibers. Among all carbon-based materials, biochar was selected for its environment…

Simulation of Young’s moduli for hexagonal ZnO [0 0 0 1]-oriented nanowires: first principles and molecular mechanical calculations

2017

The authors thank A Gulans, B Polyakov and S Vlassov for stimulating discussions. This study has been supported by the ERA.Net RUS Plus project No. 237 Watersplit. AB, RE and SL acknowledge the financial support by the Russian Foundation for Basic Research (Grant No. 17-03-00130-a) and the assistance of the Saint Petersburg State University Computer Center in the accomplishment of high-performance computations.

Twin coarsening in CdTe(111) films grown on GaAs(100)

2006

Abstract We present a scanning force microscopy study of twin coarsening in CdTe(1 1 1) films grown on GaAs(1 0 0). Two types of CdTe(1 1 1) twins grow epitaxially and with equal probability on the long-range wavy surface structure developed by previous in situ annealing of the GaAs(1 0 0) substrate. Due to this initial substrate wavy structure, the grain coarsening during film growth leads to a quasi-one-dimensional rippled pattern. We propose a coarsening mechanism between twins driven by the formation of stacking faults.

1994

Ab initio LCAO study of the atomic, electronic and magnetic structures and the lattice dynamics of triclinic CuWO4

2013

Abstract The electronic, structural and phonon properties of antiferromagnetic triclinic CuWO 4 have been studied using the first-principles spin-polarized linear combination of atomic orbital (LCAO) calculations based on the hybrid exchange–correlation density functional (DFT)/Hartree–Fock (HF) scheme. In addition, the local atomic structure around both Cu and W atoms has been probed using extended X-ray absorption fine structure (EXAFS) spectroscopy. We show that, by using the hybrid DFT–HF functional, one can accurately and simultaneously describe the atomic structure (the unit cell parameters and the atomic fractional coordinates), the band gap and the phonon frequencies. In agreement w…

Ferroelectric liquid-crystalline elastomers

1994

Oriented liquid-crystalline (LC) elastomers (polar monodomains, concerning the direction of polarisation) have been prepared from polar monodomains of ferroelectric LC-polysiloxanes by a radical photocrosslinking process. Attempts to perform ferroelectric switching lead in these soft elastomers to an elastic stress which prohibits—for low voltages—a complete reorientation of the polar axis (ferroelectric switching). A ferroelectric switching can, however, be observed for high voltages. The loop of hysteresis of this switching is asymmetric concerning the zero point of the driving voltage. Piezoelectric measurements show that these elastomers combine an elastic memory for one polar state wit…