In this paper we report the properties of the anodic silicon dioxide film formed using light-induced anodisation (LIA) method and its potential to be used as surface passivation layer of p-type silicon surfaces of silicon solar cells. The high uniformity of the formed oxide is possibly due to the uniform drift of the positive charge carriers in the silicon to the surface being anodised. The oxide grows at higher rate than that in nitric acid, an oxide layer with thickness of 18 nm can be formed by anodising for 10 min with 15 V bias in 0.5 M sulphuric acid. After annealing in oxygen and then forming gas at 400 °C for 30 min, an average effective carrier lifetime of 120 μs was measured by quasi-steady state photoluminance on 180 μm p-type 3-5 Ohm cm Cz silicon wafers, with a value of 110 μs being measured for the same wafers passivated by a thermally-grown oxide of the same thickness. The properties of the anodic silicon dioxide layers formed by LIA have been characterized by ellipsometry, x-ray photoelectron spectroscopy, quasi-steady state photoluminance and Fourier transform infrared spectroscopy.

Semi-crystalline structures were prepared from different processing condition. Biaxial oriented melt were crystallized at 375 K and atmospheric pressure for 10 nanoseconds (ns), to generate a lamellar semi-crystalline structure. Similar structures were also prepared from deformation of a cubic amorphous initial structure isothermally at 375 K. For comparison, two different thermostats, the constant stress (NPT) and constant volume (NVT) conditions were applied to the system during 10 ns of crystallization. The semi-crystalline samples shared common morphological features such as in the crystallinity, crystal orientation, lamellae thickness and density distribution, etc. However, during the subsequent uniaxial tensile deformation test of the samples to strain of 0.5, different stress-strain behaviors were demonstrated. By combining the observations of morphologies during deformation tests and analysis of the stress-strain curves, conclusions were made that the effectiveness of the network had a strong influence on the mechanical property and strain hardening behavior. The oriented network from the constant stress crystallization, owing to the taut chains, gave rise to optimal mechanical response with substantial strain-hardening.

In the current research, we have utilized sol-gel electrophoresis technique to grow PbTiO3 nanotube arrays in porous anodic alumina template channels. By using this method high quality and more condense nanotubes are obtained compared with other usual sol-gel methods. Also, the effect of the anodizing parameters on the diameter of the template pores, and effect of electrophoresis voltage on wall thickness were investigated.

The optical properties and electronic structure of AlPO4, SiO2, Type I collagen, and DNA were examined to gain insight into the van der Waals-London dispersion behavior of these materials. Interband optical properties of AlPO4 and SiO2 were derived from vacuum ultraviolet spectroscopy and spectroscopic ellipsometry, and showed a strong dependence on the crystals’ constituent tetrahedral units, with strong implications for the role of phosphate groups in biological materials. The UV-Vis decadic molar absorption of four DNA oligonucleotides was measured, and showed a strong dependence on composition and stacking sequence. A film of Type I collagen was studied using spectroscopic ellipsometry, and showed a characteristic shoulder in the fundamental absorption edge at 6.05 eV. Ab initio calculations based on density functional theory corroborated the experimental results and provided further insights into the electronic structures, interband transitions and vdW-Ld interaction potentials for these materials.

Aluminum doped ZnO (AZO) has been deposited on (100), (110) and (111) oriented n-type Si and on fused silica by atomic layer deposition (ALD). The films have been post deposition annealed in the temperature range 200-500 οC. The AZO films have been characterized by X-ray diffraction (XRD), Hall and transmittance measurements. Circular diodes have been fabricated from the AZO/Si structures and characterized by current-voltage (IV) and deep level transient spectroscopy (DLTS). The AZO films form Schottky junctions with the Si substrates for all the crystallographic orientations. It is established that after post deposition annealing the structure AZO/n-Si (110) is distinguished as the system with largest rectification.

Grain boundaries (GBs) in polycrystalline silicon (poly-Si) thin film solar cells are frequently found to be detrimental for device performance. Biaxiallytextured silicon with grains that are well-aligned in-plane and out-of-plane can possess fewer GB defects. In this work, we use TCAD Sentaurus device simulator and known experimental work to investigate and quantify the potential performance gains of biaxially-textured silicon. Simulation shows there can be performance gain from well-aligned grains when GB defects dominate carrier recombination or when grains are small. On the other hand, when intra-grain defects dominate recombination and grains are large, well-aligned grains do not lead to much performance gain. Another important result from our simulation is when intra-grain and GB defects are few, Jsc is almost independent of grain size while Voc drops with decreasing grain size.

The key material behavior of graphene, a single layer of carbon lattice, is extremely sensitive to its dielectric environment. We demonstrate improvement in electronic performance of graphene nanowire interconnects with full encapsulation by lattice-matching, chemically inert, 2D layered insulator hexagonal boron nitride (h-BN). A novel layer-based transfer technique is developed to construct the h-BN/MLG/h-BN heterostructures. The encapsulated graphene wires are characterized and compared with that on SiO2 or h-BN substrate without top passivating h-BN layer. Significant improvements in maximum current-carrying density, breakdown threshold, and maximum power density in encapsulated graphene wires are observed. These critical improvements are achieved without compromising the carrier transport characteristics in graphene. Furthermore, graphene wires exhibit electrical behavior much less insensitive to ambient conditions, as compared with the non-passivated ones. Overall, h-BN/graphene/h-BN heterostructure presents a robust material platform towards the implementation of high-performance carbon-based interconnects.

The topic of Urban Solid Waste (USW) has become increasingly controversial in our times due to the high volumes being produced and not disposed properly; one effective way to reduce the generation of USW is finding new ways to recycling. This study proposes a means of recycling Tetra Brik® (TBr) cartons and high density polyethylene recycled containers (HDPEr), by generating an agglomerate with optimal mechanical properties in comparison with other TBr-based agglomerates. For the analysis of this material’s mechanical properties, two types of evaluation tests are carried out; flexure and screw pull-out test. Results show significant mechanical advantages over other TBr-based laminates by the integration of an HDPEr matrix to the system, thereby improving mechanical properties.

The iridescent colors of Morpho butterflies have captured scientific intrigue for over a century. However, only recently photonic structures of the wing scales of Morpho butterflies have inspired new ideas in the diverse areas of technology including sensing. In this study, we performed theoretical and experimental evaluation of vapor-induced reflectance changes of the Morpho scales. These experiments provided additional details of the origin and the magnitude of vapor response selectivity in these natural photonic nanostructures and facilitated our design and fabrication of highly selective biomimetic photonic nanostructures.

We report simulation of optical properties of hybrid geometry comprised of multilayer graphene shell encapsulated gold nanoparticles loaded with carbon nanotubes. The discrete dipole approximation (DDA) method was employed. The results indicated that the optical properties of encapsulated gold nanoparticles were not suppressed by the carbon material coating. Furthermore, low scattering effects were also observed. The simulation method helped visualize the near-surface normalized electric field, which is directly related to the intensity of hot spots on the surface of these hybrid nanoarchitectures.

Magnetic/fluorescent (magnetofluorescent) materials have become one of the most important tools in the imaging modality in vivo using magnetic resonance imaging (MRI) and fluorescence imaging. We succeeded in fabricating magnetofluorescent nanoparticles (MFNPs) consisting of silicon/magnetite composite nanoparticles. Our unique synthetic approach can control simultaneously the magnetic and fluorescence behaviors by varying the particle size, demonstrating the superparamagnetic behavior and green fluorescence for the MFNPs having mean diameter of 3.0 nm, and the ferromagnetic behavior without fluorescence for the MFNPs having mean diameter more than 5.0 nm. More intriguingly, the MFNPs with superparamagnetism can detect green fluorescence even after the magnetic guidance of MFNPs by the commercial neodymium magnet. Additionally, the MFNPs having two magnetic behaviors also possess good biocompatibility.

Taking the advantage of nanomaterials to protect the environment and avoiding the side effect need a fundamental understanding of the growth mechanism of the nanomaterials. Here, the van der Waals interaction between a nanoparticle and a nanotube in the oriented-attachment growth of nanotubes is quantitatively evaluated for the first time. In particular, the correlation between van der Waals interaction and the growth parameters is investigated in depth. Our work opens up the opportunity of studying the important interparticle interactions in the oriented attachment growth of nanotubes.

The accumulation of boron within the porous nickel ferrite (NiFe2O4, NFO) deposits on nuclear fuel rods is a major technological problem with important safety and economical implications. In this work, first-principles results are combined with experimental thermochemical data to analyze the energetics of vacancy formation in NFO and the possibility of B incorporation into the structure of NFO. Under solid-solid equilibrium conditions, the calculations suggest that vacancy formation and B incorporation into the NFO structure is energetically unfavorable, the main limiting factors being the narrow stability domain of NFO and the precipitation of B2O3, Fe3BO5, and Ni3B2O6 as secondary phases. Assuming solid-liquid equilibrium between NFO and the surrounding aqueous solution saturated with respect to NFO, the calculations predict that in operating PWR environment, Ni vacancies are likely to form. Under these conditions the possibility of B incorporation at the Ni vacancy sites cannot be excluded.

Thermoelectric energy recovery is an important technology for recovering waste thermal energy in high-temperature industrial, transportation and military energy systems. Thermoelectric (TE) power systems in these applications require high performance hot-side and cold-side heat exchangers to provide the critical temperature differential and transfer the required thermal energy to create the power output. Hot-side and cold-side heat exchanger performance is typically characterized by hot-side and cold-side thermal resistances, Rh,th and Rc,th, respectively. Heat exchanger performance determines the hot-side temperature, Th, and cold-side temperature, Tc, conditions when operating in energy recovery environments with available temperature differentials characterized by exhaust temperatures, Texh, and ambient temperature, Tamb. This work analytically defined a crucially important design relationship between (P/Pmax) and (Rh,th / Rc,th) in TE power generation systems to determine the optimum ratio of (Rh,th / Rc,th) maximizing TE system power. A sophisticated integrated TE device / heat exchanger analysis was used, which simultaneously integrates hot- and cold-side heat exchanger models with TE device optimization models incorporating temperature-dependent TE material properties for p-type and n-type materials, thermal and electrical contact resistances, and hot side and cold side heat loss factors. This work examined the (P/Pmax) - (Rh,th / Rc,th) relationship for system designs employing single-material and segmented-material TE couple legs with various TE material combinations, including bismuth telluride alloys, skutterudite compounds, and skutterudite / bismuth telluride segmented combinations. This work defined the non-dimensional functional relationships and found the optimum thermal resistance condition: (Rh,th / Rc,th)opt > 10 to 30 created the maximum power output in TE optimized designs for various TE material combinations investigated. The non-dimensional relationships were investigated for various electrical contact resistances, differing thermal loss factors, and at various hot-side/cold-side temperature conditions. This work showed that the non-dimensional functional relationships were invariant under these differing conditions. It was determined that a condition of (Rh,th / Rc,th) = 1 creates power output far below maximum power conditions. The (P/Pmax) - (Rh,th / Rc,th) relationship also dictated certain temperature profile conditions, defined by the parameter, (Th – Tc) / (Texh – Tamb), which were directly associated with design points in this relationship including maximum power points. The value of (Th – Tc) / (Texh – Tamb) was generally less than 0.5 at maximum power conditions in TE energy recovery designs using TE materials investigated here. The wide-ranging ramifications on TE energy recovery systems and their design optimization for industrial and transportation-related applications are discussed.

A novel atom probe tomography (APT) method has been developed that enables a full description of the orientation relationship between individual grains to be determined together with estimates of the extents of solute segregation for all elements over the surface of the grain boundary with 1 nm by 1 nm spatial resolution. This approach also enables variations in the solute excess for the elements with the habit plane and curvature of the grain boundary to be evaluated. The method has been applied to a mechanically-alloyed nanostructured ferritic alloy (NFA) after high dose heavy ion irradiation. The innovative high-resolution two-dimensional mapping of the solute segregation across the surface of grain boundaries in the NFA clearly demonstrates that the distributions of chromium and tungsten are not uniform across the grain boundaries, and the distributions correlate with changes in its local curvature and the position of the grain boundary precipitates. These features pin the grain boundary against grain growth and provide the stability for excellent creep properties.

In this paper we show that a wide variety of composite structures can be obtained from structuring with multiaxial fields. The properties of these composites are highly responsive to field structuring and so significant increases in a variety of properties can be obtained. These composites have application as high-strain actuators, strain and temperature sensors, chemical sensors, and as thermal interface materials. We discuss these issues and provide a general summary of the research we have done in this area.

The present work focuses on the fabrication of environmental friendly ZnO nanocrystals and chitosan/cellulose films hosting ZnO nanoparticles (NPs) as an attempt to produce nanocomposites with enhanced bactericidal capacity. The solution casting method was used to fabricate the chitosan/cellulose blend films. Highly monodisperse ZnO nanoparticles were synthesized using Zinc acetate and Triethylene glycol (TEG) via a modified Polyol route. ZnO crystal size was controlled by the heterogeneous nucleation approach. Optical properties of ZnO nanoparticles were studied by UV–vis spectroscopy and Photoluminescence Spectroscopy (PL) techniques. The nanoparticles’ size and morphology were determined by Transmission Electron Microscopy (TEM) and X-ray diffraction (XRD), respectively. Obtained results confirmed the effectiveness of the size-controlled synthesis employed. The chitosan/cellulose/ZnO nanocomposites were characterized by Fourier Transform – Infrared spectroscopy (FTIR) and X-ray diffraction (XRD) methods. The mechanical properties of produced bare and ZnO-bearing composites were determined from stress-strain tests. The Standard Plate Count and the Halo Zone methods were used to evaluate the bactericidal properties of the ZnO nanoparticles, chitosan/cellulose blend films and chitosan/cellulose/ZnO nanocomposites against Escherichia coli (ATCC 35218).

Poly (3-hexylthiophene) (P3HT) thin films were deposited using emulsion-based, resonant infrared matrix-assisted pulsed laser evaporation (RIR-MAPLE) from emulsions containing different solvents and different alcohols, to investigate the impact of emulsion on film morphology. The atomic force microscopy (AFM) and grazing-incidence, wide angle x-ray scattering (GIWAXS) results show that surface morphology of RIR-MAPLE as-deposited films can be varied from rough to smooth and the microcrystalline domain orientations with respect to the substrate can be tuned from randomly oriented to preferentially oriented in the vertical direction. The demonstrated ability to tune the structural characteristics of polymer thin films by controlling the target emulsion is important for the application of organic optoelectronic devices deposited by RIR-MAPLE.

The effect of the heat input on the mechanical and metallurgical properties of the welds has been investigated in the heat affected zone (HAZ) of welds joined with gas metal arc welding (GMAW), using normal production welding parameters. The thermal effect in the HAZ of the welds is important for the optimization of the welding parameters used when weld transformed induced plasticity (TRIP) steels, because this will have a great influence in the mechanical and metallurgical properties of the weld. In this work 3 samples was welded a high, average and low heat input, with the variation of welding parameters to obtain different thermal affectation to investigate the variations in different parts of weld joint: weld, HAZ and base metal, due the heat applied for the welding process used. Mechanical properties were evaluated by tension test, microhardness and fatigue testing and metallurgical evaluation with optical metallograpy, scanning electron microscopy (SEM), fractograpy and X-Ray diffraction (XRD).The results obtained shows that the mechanical properties of the tension test decrease when the heat input increase and the microhardness exhibit a softening zone in the HAZ with lower hardness and the fatigue life were similar for all heat inputs for the high stress levels, but only in low stress there is a difference. For metallurgical properties the metallographic evaluation shows ferrite, bainite - martensite and retained austenite, and the fractography analysis exhibit a ductile fracture in all cases and the content in volume fraction of retained austenite increases in the HAZ of welds when increasing heat input in to the base metal due the thermal effect.