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 exploit theoretically a magneto-controlled nonlinear optical material which contains ferromagnetic nanoparticles with a non-magnetic metallic nonlinear shell in a host fluid. Such an optical material can have anisotropic linear and nonlinear optical properties and a giant enhancement of nonlinearity, as well as an…
Electronic structures and optical excitations in Moebius conjugated polymers are studied theoretically. Periodic and Moebius boundary conditions are applied to the tight binding model of poly(para-phenylene), taking exciton effects into account. We discuss that oligomers with a few structural units are more effective…
We have performed ab initio molecular dynamics simulations to study the nature of the synchronous double proton transfer in formic acid dimer. In order to understand the evolution of the bonding during the double proton transfer, we have used the electron localization function and the molecular orbital isosurfaces. Du…
We present valence electron Compton profiles calculated within the density-functional theory using the all-electron full-potential projector augmented-wave method (PAW). Our results for covalent (Si), metallic (Li, Al) and hydrogen-bonded ((H_2O)_2) systems agree well with experiments and computational results obtaine…
Molecular simulations and an energy landscape analysis are used to investigate the effects of shear on aging in a glass. Shear beyond the yield point is shown to change the state of a glass such that it resembles (but is not identical to) a different stage in the aging process. A cycle of large strain rejuvenates the…
The evolution of microstructure and texture of a 0.2%C–Mn steel during large strain warm deformation and subsequent annealing has been investigated. The process of grain subdivision during warm deformation is essential for the formation of ultrafine grains in such a material. The study reveals that pronounced recovery…
Reflection high-energy electron diffraction (RHEED) is the analytical tool of choice for characterizing thin films during growth by molecular beam epitaxy, since it is very sensitive to surface structure and morphology. This 2004 book serves as an introduction to RHEED for beginners and describes detailed experimental…
We introduce a new, highly sensitive, and simple heterodyne optical method for imaging individual nonfluorescent nanoclusters and nanocrystals. A 2 order of magnitude improvement of the signal is achieved compared to previous methods. This allows for the unprecedented detection of individual small absorptive objects s…
Red, white, and blue: White light was obtained by partial energy transfer (∂ET) between a blue-emitting IrIII–phenylpyridine complex and a red-emitting EuIII–terpyridine chelate through excitation of the assembly that is formed from the two metal complexes (see picture).
Recently there has been a great deal of progress in the production of one-dimensional nanostructures with core-sheath structures from a rich variety of materials. Here we highlight the use of electrospinning in the fabrication of polymeric, ceramic, and composite nanofibers with core-sheath, hollow, or porous structur…
ZnO nanowire field-effect transistors (FETs) were fabricated and studied in vacuum and a variety of ambient gases from 5 to 300 K. In air, these n-type nanowire transistors have among the highest mobilities yet reported for ZnO FETs (mu(e) = 13 +/- 5 cm(2) V(-1) s(-1)), with carrier concentrations averaging 5.2 +/- 2.…
High-resolution soft X-ray emission and absorption spectra near the N K-edge of wurtzite GaN are presented. The experimental data are interpreted in terms of band structure based full-potential electronic structure calculations. The absorption spectra, compared with calculations including core hole screening, indicate…
Transport property is investigated in [Ca$_{2}$CoO$_{3-δ}$]$_{0.62}$[CoO$_{2}$] single crystals obtained by varying annealing conditions. The $ρ_{ab}(T)$ exhibits a resistivity minimum, and the temperature corresponding to this minimum increases with the loss of oxygen content, indicative of the enhancement of spin de…
Single crystals of Na$_{0.5}$CoO$_2$ were obtained through a flux method followed by de-intercalation of sodium. The Na$_{0.5}$CoO$_2$ samples were found to be vulnerable to water in the air and a hydration process in which H$_2$O molecules fill oxygen vacancies in CoO$_2$ layers is suggested to be responsible for the…
Polarization-dependent x-ray absorption measurements were performed on a crystalline ZnO three-dimensional array consisting of highly oriented microrods as well as on particulate thin film consisting of monodisperse spherical nanoparticles. Strong anisotropic effects have been observed for the highly oriented ZnO rods…
Giant volume magnetostriction at room temperature is found for the first time in a La(0.7)Ba(0.3)MnO(3) single crystal, achieving 2.54 × 10(-4) in a magnetic field of 8.2 kOe. An even greater value of the volume magnetostriction, equal to 4 × 10(-4) in the same magnetic field, is observed at the Curie point T(C) = 310…
Abstract The dechlorination of polyvinylchloride (PVC) powder initially progressed on an apparent zero order reaction, and proceeded in higher dechlorination range by an apparent first order reaction. The apparent activation energies indicate that the rate of the dehydrochlorination is controlled by the chemical react…
Improved understanding of the plastic deformation of metals during high-strain-rate shock loading is key to predicting their resulting material properties. This paper presents the results of molecular-dynamics simulations which address two fundamental questions related to materials deformation: the stability of supers…
Structural and transport properties of ceramic LaMnO(3+δ) are investigated for δ = 0-0.154. According to x-ray diffraction measurements at room temperature the crystal structure of this compound varies from orthorhombic (Pbnm) for δ = 0 to rhombohedrally distorted cubic (Pm3m) for δ = 0.065-0.112 and to rhombohedral (…
Water-soluble Prussian-blue (PB) analogue transition metal hexacyanoferrate (HCF) nanoparticles FeHCF, CoHCF, NiHCF and CuHCF have been synthesized by using poly(N-vinyl-2-pyrrolidone) as a protective matrix. Transmission electron microscopy (TEM) images of the synthesized PB analogues showed stable and well dispersed…