Materials Literature
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Nanoparticles are often used as seeds to grow one-dimensional nanomaterials or as core materials to prepare core−shell nanostructures. On the other hand, the presynthesized inorganic nanoparticles can also be used as starting building blocks to prepare inorganic−polymer nanocomposites. In this work, we explore the rol…
We consider 2- and 3-dimensional cubic monocrystalline and polycrystalline materials. Expressions for Young's and shear moduli and Poisson's ratio are expressed in terms of eigenvalues of the stiffness tensor. Such a form is well suited for studying properties of these mechanical characteristics on sides of the stabil…
The ordered magnetic states of ${\text{MnWO}}_{4}$ at low temperatures were examined by evaluating the spin exchange interactions between the ${\text{Mn}}^{2+}$ ions of ${\text{MnWO}}_{4}$ on the basis of first principles density functional calculations and by performing classical spin analysis with the resulting spin…
We develop a theory of the effective disorder temperature in glass-forming materials driven away from thermodynamic equilibrium by external forces. Our basic premise is that the slow configurational degrees of freedom of such materials are weakly coupled to the fast kinetic-vibrational degrees of freedom and therefore…
This is the first of three papers devoted to the nonequilibrium thermodynamics of amorphous materials. Our focus here is on the role of internal degrees of freedom in determining the dynamics of such systems. For illustrative purposes, we study a solid whose internal degrees of freedom are vacancies that govern irreve…
New gold nanorod (Au NR)-in-shell nanostructures were developed to be more efficacious than Au NRs in near-IR (NIR) hyperthermia and nonlinear optical imaging contrast. Au NR-in-shell nanostructures are composed of an intact Au NR in a Au/Ag nanoshell. These nanostructures have a broad, intense absorption band that ex…
Introduction Economic Losses Indirect Losses Conservation Losses Nonmetallic Materials Summary Corrosion Mechanisms Cell Potentials Types of Local Cell Formations Potential-pH Diagrams Polarization Measuring Polarization Other Factors Affecting Corrosion Corrosion Rate Measurement Forms of Metallic Corrosion General (…
This study investigated the effect of the particle size of silica colloidal suspension (SCS) in SCS-impregnated plain woven fabrics on the ballistic performance of those fabrics. In order to examine the particle size effect, spherical silica particles with average diameters of 100 nm, 300 nm, and 500 nm were used to f…
We investigate the molecular first hyperpolarizability (beta) for donor/acceptor (D/A) substituted pi-conjugated organic molecules with different D/A groups and pi-systems (including up to eight pi-bonds). The results of the MP2 and density functional theory (PBE0, BMK, M05, M05-2X) calculations are compared to those…
We report first-principles calculations on the electronic and structural properties of chemically functionalized adamantane molecules, either in isolated or crystalline forms. Boron and nitrogen functionalized molecules, aza-, tetra-aza-, bora-, and tetra-bora-adamantane, were found to be very stable in terms of energ…
In this study, we evaluated the role of fiber size scale in the adhesion and spreading potential of human mesenchymal stem cells (hMSCs) on electrospun poly(caprolactone) (PCL) nanofibrous and microfibrous scaffolds. The effect of in vivo regulators in inducing osteogenic differentiation of hMSCs on PCL nanofibrous sc…
The future of nanotechnology rests upon approaches to making new, useful nanomaterials and testing them in complex systems. Currently, the advance from discovery to application is constrained in nanomaterials relative to a mature market, as seen in molecular and bulk matter. To reap the benefits of nanotechnology, imp…
Photoirradiation of a solution of BH(3).NHR(2) (1a: R = Me, 1b: R = 1/2C(4)H(8), 1c: R = 1/2C(5)H(10), 1f: R = Et) containing a catalytic amount of a group-6 metal carbonyl complex, [M(CO)(6)] (M = Cr, Mo, W), led to dehydrogenative B-N covalent bond formation to produce aminoborane dimers, [BH(2)NR(2)](2) (2a-c, f),…
Digital imaging has traditionally been enabled by single-crystalline photodetectors. This approach typically either mandates the use of silicon as photon-to-electron converter or requires a hybrid-integrated solution. In contrast, solution-processed optoelectronic materials offer convenient integration of light-sensin…
Applications of water-dispersible near-infrared (NIR)-emitting quantum dots (QDs) have been hampered by their instability and low photoluminescence (PL) efficiencies. In this paper, water-soluble highly luminescent NIR-emitting QDs were developed through constructing CdTe/CdSe/ZnS core/shell/shell nanostructure. The C…
Based on the assumption that the contact barrier height determines the current flow in organic semiconductor-based electronic devices, charge injection at metal-organic (MO) interfaces has been extensively investigated, while space-charge conduction in organic bulk is generally overlooked. Recent theoretical modeling…
The formation mechanisms of evaporated Pd islands on the reconstructed Au(111) $22 /times /sqrt{3}$ herringbone surface have been here studied by Scanning Tunneling Microscopy (STM) at room temperature. Atomically resolved STM images at the very early stages of growth provide a direct observation of the mechanisms inv…
The transition-metal oxide ${\text{CaCu}}_{3}{\text{Ru}}_{4}{\text{O}}_{12}$ with perovskite-type structure shows characteristic properties of an intermediate-valence system. The temperature-dependent susceptibility exhibits a broad maximum around 150--160 K. At this temperature, neutron powder diffraction reveals a s…
Ferroelectric soft mode in Pb(Mg1/3Nb2/3)O3 (PMN) has been clearly resolved by precision Raman scattering measurements for the first time. A polarization direction of the incident laser was chosen along [110] in cubic configuration in order to eliminate strong scattering components around 45 cm-1, which always smeared…
We report on a model of polymer nanocomposites with fibrous fillers which explicitly considers the microscopic filler features and replicates the composites as random distributions of particles interconnected via electron tunneling. By exploiting the critical path method, we are able to obtain simple formulas, applica…