Materials Literature
按标题、摘要、年份、主题和来源检索公开元数据。结果保留作者、摘要、分类与原始来源链接。
We develop the theory for grazing incidence small-angle x-ray scattering (GISAXS) from nanometer-sized naked islands on a flat substrate in the framework of the distorted-wave Born approximation (DWBA). The scattered wave amplitude is composed of four terms, including all combinations of scattering from the islands an…
In our previous publication we have mistakenly claimed that the applicability of the Hellmann-Feynman theorem in fixed-node quantum Monte Carlo calculations is not subject to the manner how the nodal boundary depends on an external parameter. This statement is not correct in general, except where the Hellmann-Feynman…
The resistance R of a high-density network of 6-nm-diam Bi wires in porous Vycor glass is studied in order to observe its expected semiconductor behavior. R increases from 300 K down to 0.3 K. Below 4 K, where R varies approximately as $\mathrm{ln}(1/T),$ the order of magnitude of the resistance rise, as well as the b…
The Monte Carlo method is used to simulate electron transport for electric field strengths up to 350 kV/cm in bulk, wurtzite structure ZnO. The relevant parts of the conduction bands of a first-principles band structure are approximated by spherically symmetric, nonparabolic valleys located at the Γ and Umin symmetry…
We present first-principles approaches based on density functional theory for calculating positron states and annihilation characteristics in condensed matter. The treatment of the electron-positron correlation effects (the enhancement of the electron density at the positron with respect to mean-field density) is show…
The four-state model is proposed for description of phase transition in ferroelectric crystals of DMAGaS and DMAAlS type. Thermodynamical functions of the model are obtained in the mean field approximation. The phase transition between paraelectric and ferroelectric phases is investigated. It is established that order…
Nanofibers of a commercial styrene–butadiene–styrene triblock copolymer were electrospun from solution, and collected either as a nonwoven elastomeric fabric, or on a layer of graphite that was evaporated onto a glass microscope slide. The resulting nanofibers were elastic, birefringent, and most had diameters around…
Using the epitaxial strain, the magnetic and electronic phases can be controlled for thin films of the manganites, La 1- x Sr x MnO 3 , grown on perovskite substrates with various lattice parameters. The strain-induced orbital-ordering (disordering) via coupling with the cooperative Jahn-Teller distortion produces dif…
Effective boundary conditions, in the form of two-sided impedance boundary conditions, are formulated for the linear electrodynamics of single- and multishell carbon nanotubes (CN's). The impedance is derived using the dynamic conductivity of CN's, which is obtained for different CN's (zigzag, armchair, and chiral) in…
Isobutylene (IB) polymerization kinetics at −80 °C were monitored in real time using mid-infrared ATR-FTIR spectroscopy, with diamond-composite insertion probe and light conduit technology. Monomer concentration as a function of time was obtained by monitoring the absorbance at 887 cm -1 associated with the CH 2 wag o…
Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a “Full Text” option. The original article is trackable via the “References” opt…
The synthesis, characterization, and polymerization of a new cyclic ester, γ-bromo-ε-caprolactone (γBrCL), are reported. The ring-opening polymerization (ROP) of this new monomer initiated from Al(O i Pr) 3 as initiator in toluene at 0 °C was found to be living and proceeds by a coordination−insertion mechanism. Rando…
The effect of damping of spinwaves in a two-dimensional classical ferromagnetic XY model is considered. The damping rate $Γ_{q}$ is calculated using the leading diagrams due to the quartic-order deviations from the harmonic spin Hamiltonian. The resulting four-dimensional integrals are evaluated by extending the techn…
The cationic, neutral, and anionic charge states of the B 13 cluster are examined through the use of density functional theory. Several different isomers are studied and compared with a special emphasis given to the electronic structure of the lowest lying isomers. Included among the isomers are three which have been…
Hall crosses were used to measure the magnetic properties of arrays of ferromagnetic, nanometer-scale iron particles. The arrays typically consist of several hundred particles of 9 -- 20 nm in diameter. It is shown that the sensitivity of the measurements can be improved by matching the areas of the Hall cross and the…
A glass surface may still flow below the bulk glass transition temperature, where the underlying bulk is frozen. Assuming the existence at T=T* of a bulk thermodynamical glass transition, we show that the glass-vapor interface is generally wetted by a liquid layer of thickness ~ -ln(T*-T) when T--> T*. Contrary to sta…
In-plane magnetic field is found to change drastically the photoluminescence spectra and kinetics of interwell excitons in GaAs/AlGaAs coupled quantum wells. The effect is due to the in-plane magnetic field induced displacement of the interwell exciton dispersion in a momentum space, which results in the transition fr…
We propose a new model to implement organic exciton-semiconductor exciton hybridization by embedding a semiconductor quantum dot array into an organic medium. A Wannier-Mott transfer exciton is formed when the exciton in each semiconductor dot interacts via the multipole-multipole coupling with other excitons in the d…
This study concerns a molecular dynamics (MD) simulation, using the embedded-atom method (EAM), of the self-diffusion of an interstitial in the bcc metal tungsten (W) at 2000 K. It is found that the interstitial moves only along 111 diagonals and that the switches to other non-parallel directions take place through a…
We introduce a schematic nonlinear diffusion model where density fluctuations induce a rich out-of-equilibrium dynamics. The properties of the model are studied by numerical simulations and analytically in a mean field approximation. At low temperatures and high densities we find a long off-equilibrium glassy region,…