Materials Literature
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Different methods of texturing polycrystalline materials are developed over years to use/probe anisotropic material properties with relative ease, where complicated and expensive single crystal growth processes could be avoided. In this paper, particle morphology assisted texturing in multiferroic MnWO$_4$ has been di…
We investigate the radiation properties of two types of elementary sources embedded in a uniaxial wire medium: a short dipole parallel to the wires and a lumped voltage source connected across a gap in a generic metallic wire. It is demonstrated that the radiation pattern of these elementary sources may have quite ano…
Au-seed Ag-growth nanoparticles of controllable diameter (50-100 nm), and having an ultrathin SiO(2) shell of controllable thickness (2-3 nm), were prepared for shell-isolated nanoparticle-enhanced Raman spectroscopy (SHINERS). Their morphological, optical, and material properties were characterized; and their potenti…
Rapid sphere-to-prism (STP) transformation of silver was studied in aqueous AgNO(3)/NaBH(4)/polyvinylpyrrolidone (PVP)/trisodium citrate (Na(3)CA)/H(2)O(2) solutions by monitoring time-dependent surface plasmon resonance (SPR) bands in the UV-vis region, by examining transmission electron microscopic (TEM) images, and…
Transformation of graphene flakes to fullerenes assisted by Ni clusters is investigated using molecular dynamics simulations. The bond-order potential for Ni-C systems is developed. The potential reproduces the experimental and first-principles data on the physical properties of pure Ni as well as on relative energies…
Fluorescent DNA-AgNCs have emerged as an alternative to standard emitters because of their unique properties: high fluorescent quantum yield, photostability, a broad pallet of colors (blue to near-IR), and the fact that their properties are easily modulated by the DNA sequence and environment. Applications as gene, io…
Despite significant progress in high-throughput methods in macromolecular crystallography, the production of diffraction-quality crystals remains a major bottleneck. By recording diffraction in situ from crystals in their crystallization plates at room temperature, a number of problems associated with crystal handling…
A dodecagonal quasicrystalline (QC) morphology is identified in a poly(styrene-b-isoprene-b-styrene-b-ethylene oxide) (SISO) tetrablock terpolymer based on evidence provided by transmission electron microscopy (TEM), small-angle X-ray scattering, and dynamic mechanical spectroscopy measurements. The QC state occurs at…
We present a novel cluster-expansion (CE) approach for the first-principles modeling of temperature and concentration dependent alloy properties. While the standard CE method includes temperature effects only via the configurational entropy in Monte Carlo simulations, our strategy also covers the first-principles free…
Ultrathin FeAs is of interest both as the active component in the recently identified pnictide superconductors and in spintronic applications at the interface between ferromagnetic Fe and semiconducting GaAs. Here we use first-principles density-functional theory to investigate the properties of FeAs/GaAs heterostruct…
Unipolar transport is demonstrated in a bilayer graphene with a series of p-n junctions and is controlled by electrostatic biasing by a comb-shaped top gate. The OFF state is induced by multiple barriers in the p-n junctions, where the band gap is generated by applying a perpendicular electric field to the bilayer gra…
We have developed first-principles models, based on a general parametrization of the full potential-energy surface, to investigate the lattice-dynamical properties of perovskite oxides. We discuss the application of our method to prototypic ferroelectric PbTiO3, showing that its properties are drastically affected by…
Binary ruthenium pnictides, RuP and RuAs, with an orthorhombic MnP structure, were found to show a metal to a nonmagnetic insulator transition at ${T}_{\mathrm{MI}}$ $=$ 270 and 200 K, respectively. In the metallic region above ${T}_{\mathrm{MI}}$, a structural phase transition, accompanied with a weak anomaly in the…
Bioadhesion refers to the phenomenon where natural and synthetic materials adhere to biological surfaces. An understanding of the fundamental mechanisms that govern bioadhesion is of great interest for various researchers who aim to develop new biomaterials, therapies and technological applications such as biosensors.…
Abstract Minimally invasive surgery often requires devices that can change their geometry or shape when placed inside the body. Here, the potential of thermoplastic temperature‐memory polymers (TMP) for the design of intelligent devices, which can be programmed by the clinician to individually adapt their shifting geo…
The development of passivated silicon nanowire (SiNW) based micro-supercapacitor electrodes for on-chip applications using an environmentally benign aqueous electrolyte is reported. The SiNWs, produced by low-temperature (50 °C) electrochemical etching, corrode during charge/discharge cycling in the aqueous environmen…
Developing bionanocomposites from renewable biomass is a viable supplement for materials produced from mineral and fossil fuel resources. In this study, nanocomposites composed of carboxylated cellulose nanocrystals (CCNs) and silver nanoparticles (AgNPs) were prepared and used as bifunctional nanofillers to improve t…
We report a universal method for the surface-initated polymerization (SIP) of an antifouling polymer brush on various classes of surfaces, including noble metals, metal oxides, and inert polymers. Inspired by the versatility of mussel adhesive proteins, we synthesized a novel bifunctional tripeptide bromide (BrYKY) th…
An intrinsic mechanism of photoinduced hole transfer reactions occurring at the grapheme-PbS interface is described with the purpose of building a tunable photosensor with a responsivity of more than 10(3) A W(-1) . It is remarkable that rational utilization of this finding also realizes symmetric, opposing photoswitc…
The topological complexity of a crystal structure can be quantitatively evaluated using complexity measures of its quotient graph, which is defined as a projection of a periodic network of atoms and bonds onto a finite graph. The Shannon information-based measures of complexity such as topological information content,…