Materials Literature
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Abstract Homogenous mechanism of soot formation in moderate-pressure Ar/CH 4 /H 2 microwave discharges was analyzed with the help of kinetics modeling of the thermally nonequilibrium plasmas. Two main reaction mechanisms based on either neutral molecular growth and condensation reaction nucleation process were conside…
Abstract One-dimensional (1D) nanostructures have drawn continuous research attention because of their unique electrical, optical, and magnetic properties different from that of bulk and nanoparticles, as well as their potential applications in mesoscopic research and nanodevices. The main challenge in this area is ho…
Abstract The self-assembling and photophysical properties of soluble fluorescent linear condensed aromatic gelators are reported. The gels formed by 2,3-alkoxy derivatives are constituted of nanofibers weaving a 3-dimensional supramolecular network and imprisoning the solvent. These nanofibers are efficient light-harv…
The objective of this research was to investigate the activation energy and viscoelastic properties of urea-formaldehyde (UF) resin, melamine-formaldehyde (MF) resin and UF-MF resin mixtures by differential scanning calorimetry (DSC) and dynamic mechanical thermal analysis (DMTA). The purpose of adding MF resin to the…
The SIESTA suite of programs allows periodic density functional theory calculations to be carried out on system sizes of several hundred atoms. Here we make use of this to study the interface between Au and MgO surfaces. Atomic Au on MgO(100) shows preferential binding over surface anion sites, while the binding energ…
Direct ab initio mapping of induced current density in the pi system of the expanded porphyrin amethyrin shows a picture at variance with the conventional 4npi ascription of antiaromaticity. The ipsocentric orbital model interprets the pattern of currents as a superposition of shell contributions: an intense paratropi…
The objective of the present work is to compare several thermomechanical frameworks, taking into account the influence of strain gradient, internal variables, gradient of internal variables, and temperature gradient on the constitutive behavior of materials. In particular, the restrictions by the second law of thermod…
TEM analysis of mesoporous materials is generally undertaken to give qualitative results. Accurate quantitative analysis is demonstrated in this study. A systematic image analysis of a powder form of a hexagonal mesoporous material known as KIT-6 is conducted using a transmission electron microscope (TEM). Three types…
Pt–SiO2 catalysts were prepared by using water-in-oil type microemulsion. The catalysts were prepared by hydrolysis of tetraethylorthosilicate in the microemulsion containing Pt species, followed by calcination in air and reduction with H2. This preparation method for Pt–SiO2 provided Pt metal nanoparticles with a dia…
Ordered gold nanocrystal/silica particles were synthesized through self-assembly of nanocrystal micelles and silicate. Depending on the use of surfactants, and the kinetic conditions of silica hydrolysis and condensation, well-shaped and irregularly-shaped silica particles were formed, inside which the nanocrystals se…
Directed by the temperature-induced phase transformation in the alkane (from heptane to dodecane)–P123–water–TEOS quadru-component system, i.e., from a swollen inverse hexagonal phase (H2) to a swollen lamellar phase (Lα) and then to a swollen normal micelles phase (L1), complex silica materials, such as mesoporous na…
The single step synthesis of an Fe(II) porphyrin cored hyperbranched polymer, possessing similar size and topology to the natural heme containing proteins, is reported: UV spectroscopy successfully demonstrated the ability of this polymer to reversibly bind oxygen.
With the emergence of commercial grafted caged silica (Polyhedral Oligomeric Silesquioxanes, POSS) having a three-dimensional (3D) morphology with peripheral functionality, new opportunities have been created for formulating dental adhesives and composites with enhanced mechanical and physical properties. The objectiv…
Twin roll casting has been used to produce AZ31 magnesium alloy strip. The size of the cast strip is 5 mm thick and 250 mm wide. The microstructure of the as-cast AZ31 alloy strip consists of columnar zones from the surface to mid-thickness region and equiaxed zone in the mid-thickness region. The secondary dendrite a…
A series of caesium manganese hexacyanoferrates is prepared; Cs(I)(1.78)Mn(II)[Fe(II)(CN)6]0.78[Fe(III)(CN)6](0.22) (1), Cs(I)(1.57)Mn(II)[Fe(II)(CN)6]0.57[Fe(III)(CN)6](0.43) (2), Cs(I)(1.51)Mn(II)[Fe(II)(CN)6]0.51[Fe(III)(CN)6](0.49) (3), and Cs(I)(0.94)Mn(II)[Fe(II)(CN)6]0.21[Fe(III)(CN)6](0.70).0.8H2O (4). 1-3 sho…
B3LYP* functionals were used to model the sixteen iron(II) (1A, LS and 5T, HS) and iron(III) (2T, LS and 6A, HS) complexes of the 1:3 Schiff base condensate of tris(2-aminoethyl)amine and imidazole-4-carboxaldehyde, H3L1, and its deprotonated forms, [H2L1]1-, [HL1]2-, and [L1]3-. This ligand system is unusual in that…
The 4,n-alkyloxybenzoic acid 6OBAC has a very rich variety of crystalline structures and two nematic sub-phases, characterised by different textures. It is a material belonging to a family of liquid crystals formed by hydrogen bonded molecules, the 4,n-alkyloxybenzoic acids (n indicates the homologue number). The homo…
The mechanical behavior of, and damage evolution in high‐purity Cu is influenced by strain rate, temperature, stress state, grain size, and shock prestraining. The effects of grain size on the tensile mechanical response of high‐purity Cu have been probed and are correlated with the evolution of the substructure. The…
Natural rubber (NR) was foamed at different feeding ratios of carbon black and different foaming pressures. The cure characteristics were studied with respect to the carbon black content, and the effects of the foaming pressure and filler loading on the mechanical properties and morphologies of the foams were also inv…
Abstract In this paper the effect of solvents of different polarity (chloroform and acetone) on the geometry and static electric properties (dipole moment, polarizability, and first hyperpolarizability) of four nonlinear optical (NLO) chromophores is studied within the framework of the Polarizable Continuum Model (PCM…