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At least 937 records · Page 52

Linear relationship between water wetting behavior and microscopic interactions of super-hydrophilic surfaces

Using molecular dynamics simulations, we show a fine linear relationship between surface energies and microscopic Lennard-Jones parameters of super-hydrophilic surfaces. The linear slope of the super-hydrophilic surfaces is consistent with the linear slope of the super-hydrophobic, hydrophobic, and hydrophilic surfaces where stable water droplets can stand, indicating that there is a universal linear behavior of the surface energies with the water-surface van der Waals interaction that extends from the super-hydrophobic to super-hydrophilic surfaces. Moreover, we find that the linear relationship exists for various substrate types, and the linear slopes of these different types of substrates are dependent on the surface atom density, i.e., higher surface atom densities correspond to larger linear slopes. These results enrich our understanding of water behavior on solid surfaces, especially the water wetting behaviors on uncharged super-hydrophilic metal surfaces.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Order parameter and scaling behavior in BaZr{sub x}Ti{sub 1−x}O{sub 3} (0.3 < x < 0.6) relaxor ferroelectrics

We report the relaxor behavior of the zirconium doped barium titanate BaZr{sub x}Ti{sub 1−x}O{sub 3} solid solutions and discuss the temperature, frequency, and concentration dependence in terms of correlations among the polar nanoregions. The relaxor behavior is analyzed within the mean field theory by estimating the Edward-Anderson order parameter q{sub EA}. Additionally, we find that q{sub EA} calculated for the different concentrations obeys a scaling behavior q{sub EA}=1−(T/T{sub m}){sup n}, where T{sub m} are the respective dielectric maxima temperatures and n = 2.0 ± 0.1. The frequency dependence of the q{sub EA} also shows results consistent with the above mentioned picture.

36 MATERIALS SCIENCE↗

Phase behavior of the 38-atom Lennard-Jones cluster

We have developed a coarse-grained description of the phase behavior of the isolated 38-atom Lennard-Jones cluster (LJ{sub 38}). The model captures both the solid-solid polymorphic transitions at low temperatures and the complex cluster breakup and melting transitions at higher temperatures. For this coarse model development, we employ the manifold learning technique of diffusion mapping. The outcome of the diffusion mapping analysis over a broad temperature range indicates that two order parameters are sufficient to describe the cluster's phase behavior; we have chosen two such appropriate order parameters that are metrics of condensation and overall crystallinity. In this well-justified coarse-variable space, we calculate the cluster's free energy landscape (FEL) as a function of temperature, employing Monte Carlo umbrella sampling. These FELs are used to quantify the phase behavior and onsets of phase transitions of the LJ{sub 38} cluster.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Effects of pre-annealing on the uni- and bi-axial stretching behavior of poly(ethylene naphthalate) films

Effect of pre-annealing on stress and birefringence behavior of poly(ethylene naphthalate) (PEN) films during stretching and relaxation processes was investigated. Amorphous and non-oriented PEN films were pre-annealed under the conditions of different temperatures and periods. The pre-annealed films were stretched uniaxially or equi-biaxially and then relaxed at fixed length. It was found that pre-annealing did not cause any notable change for the initial behavior of refractive indices variation, whereas the behaviors after necking were significantly affected. Through the comparison between in-plane and out-of-plane birefringence and the analysis of wide-angle x-ray diffraction patterns of drawn films of both stretching modes, it was confirmed that the orientation of naphthalene ring in the film plane was enhanced by pre-annealing.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Biopolymer foams - Relationship between material characteristics and foaming behavior of cellulose based foams

Biopolymers are becoming increasingly important to both industry and consumers. With regard to waste management, CO{sub 2} balance and the conservation of petrochemical resources, increasing efforts are being made to replace standard plastics with bio-based polymers. Nowadays biopolymers can be built for example of cellulose, lactic acid, starch, lignin or bio mass. The paper will present material properties of selected cellulose based polymers (cellulose propionate [CP], cellulose acetate butyrate [CAB]) and corresponding processing conditions for particle foams as well as characterization of produced parts. Special focus is given to the raw material properties by analyzing thermal behavior (differential scanning calorimetry), melt strength (Rheotens test) and molecular weight distribution (gel-permeation chromatography). These results will be correlated with the foaming behavior in a continuous extrusion process with physical blowing agents and underwater pelletizer. Process set-up regarding particle foam technology, including extrusion foaming and pre-foaming, will be shown. The characteristics of the resulting foam beads will be analyzed regarding part density, cell morphology and geometry. The molded parts will be tested on thermal conductivity as well as compression behavior (E-modulus, compression strength)

36 MATERIALS SCIENCE↗

Substitution behavior of x(Na{sub 0.5}K{sub 0.5})NbO{sub 3}-(1 − x)BaTiO{sub 3} ceramics for multilayer ceramic capacitors by a near edge x-ray absorption fine structure analysis

The doping effect of (Na{sub 0.5}K{sub 0.5})NbO{sub 3} (NKN) as alternatives for rare-earth elements on the electrical properties of BaTiO{sub 3} has been investigated, in terms of their substitution behavior. The dielectric constant of a specimen with x = 0.05 was about 79% higher than that of pure BaTiO{sub 3}, and the temperature coefficient of capacitance was satisfied by the X7R specification. The specimen with x = 0.05 showed the lowest tetragonality among the four compositions and had a fine grain size of <2 μm. Although the addition of NKN decreased the specimen's tetragonality, the electrical properties were enhanced by the formation of defect dipoles and conduction electrons, which resulted from an acceptor and donor substitution behavior. Through O K-edge near edge x-ray absorption fine structure spectroscopy, the practical substitution behavior was defined by the change in Ti 3d orbital states. The energy separation of the Ti 3d orbitals was more apparent with the specimen of x = 0.05, which is related to the donor level from the donor substitution of Nb{sup 5+} ion for Ti-sites. Therefore, the simultaneous substitution of Na{sup +}/K{sup +} and Nb{sup 5+} ions into BaTiO{sub 3} can improve dielectric properties, based on the charge-transfer process.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Impact of composition and crystallization behavior of atomic layer deposited strontium titanate films on the resistive switching of Pt/STO/TiN devices

The resistive switching (RS) properties of strontium titanate (Sr{sub 1+x}Ti{sub 1+y}O{sub 3+(x+2y)}, STO) based metal-oxide-metal structures prepared from industrial compatible processes have been investigated focusing on the effects of composition, microstructure, and device size. Metastable perovskite STO films were prepared on Pt-coated Si substrates utilizing plasma-assisted atomic layer deposition (ALD) from cyclopentadienyl-based metal precursors and oxygen plasma at 350 °C, and a subsequent annealing at 600 °C in nitrogen. Films of 15 nm and 12 nm thickness with three different compositions [Sr]/([Sr] + [Ti]) of 0.57 (Sr-rich STO), 0.50 (stoichiometric STO), and 0.46 (Ti-rich STO) were integrated into Pt/STO/TiN crossbar structures with sizes ranging from 100 μm{sup 2} to 0.01 μm{sup 2}. Nano-structural characterizations revealed a clear effect of the composition of the as-deposited STO films on their crystallization behavior and thus on the final microstructures. Local current maps obtained by local-conductivity atomic force microscopy were in good agreement with local changes of the films' microstructures. Correspondingly, also the initial leakage currents of the Pt/STO/TiN devices were affected by the STO compositions and by the films' microstructures. An electroforming process set the Pt/STO/TiN devices into the ON-state, while the forming voltage decreased with increasing initial leakage current. After a RESET process under opposite voltage has been performed, the Pt/STO/TiN devices showed a stable bipolar RS behavior with non-linear current-voltage characteristics for the high (HRS) and the low (LRS) resistance states. The obtained switching polarity and nearly area independent LRS values agree with a filamentary character of the RS behavior according to the valence change mechanism. The devices of 0.01 μm{sup 2} size with a 12 nm polycrystalline stoichiometric STO film were switched at a current compliance of 50 μA with voltages of about ±1.0 V between resistance states of about 40 kΩ (LRS) and 1 MΩ (HRS). After identification of the influences of the films' microstructures, i.e., grain boundaries and small cracks, the remaining RS properties could be ascribed to the effect of the [Sr]/([Sr] + [Ti]) composition of the ALD STO thin films.

36 MATERIALS SCIENCE↗

Optothermal transport behavior in whispering gallery mode optical cavities

Over the past century, whispering gallery mode optical cavities have enabled numerous advances in science and engineering, such as discoveries in quantum mechanics and non-linear optics, as well as the development of optical gyroscopes and add drop filters. One reason for their widespread appeal is their ability to confine light for long periods of time, resulting in high circulating intensities. However, when sufficiently large amounts of optical power are coupled into these cavities, they begin to experience optothermal or photothermal behavior, in which the optical energy is converted into heat. Above the optothermal threshold, the resonance behavior is no longer solely defined by electromagnetics. Previous work has primarily focused on the role of the optothermal coefficient of the material in this instability. However, the physics of this optothermal behavior is significantly more complex. In the present work, we develop a predictive theory based on a generalizable analytical expression in combination with a geometry-specific COMSOL Multiphysics finite element method model. The simulation couples the optical and thermal physics components, accounting for geometry variations as well as the temporal and spatial profile of the optical field. To experimentally verify our theoretical model, the optothermal thresholds of a series of silica toroidal resonant cavities are characterized at different wavelengths (visible through near-infrared) and using different device geometries. The silica toroid offers a particularly rigorous case study for the developed optothermal model because of its complex geometrical structure which provides multiple thermal transport paths.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Electric and magnetic behaviors observed in NiO-based thin films under light-irradiation

We report the room-temperature ferromagnetic properties that can be tuned by light irradiation in the Li and Mn co-doped NiO films (LMNO) grown by the spinning coating. The optical tunable magnetic behavior is enhanced by the increase of the Li doping concentration. First-principle calculations reveal that the Li doping plays key roles in the optical tuned magnetic behavior, which brings a 3d-like impurity state to enhance a significant hybridization between the Mn{sup 3+} 3d state and the impurity band, thus strengthening the ferromagnetic coupling effects. Additionally, it can tune the band gap of the LMNO films and produce more holes under the light irradiation, enhancing the optical tuned magnetic behavior.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Charging/discharging behavior and mechanism of silicon quantum dots embedded in amorphous silicon carbide films

The charging/discharging behavior of Si quantum dots (QDs) embedded in amorphous silicon carbide (a-SiC{sub x}) was investigated based on the Al/insulating layer/Si QDs embedded in a-SiC{sub x}/SiO{sub 2}/p-Si (metal-insulator-quantum dots-oxide-silicon) multilayer structure by capacitance-voltage (C-V) and conductance-voltage (G-V) measurements. Transmission electron microscopy and Raman scattering spectroscopy measurements reveal the microstructure and distribution of Si QDs. The occurrence and shift of conductance peaks indicate the carrier transfer and the charging/discharging behavior of Si QDs. The multilayer structure shows a large memory window of 5.2 eV at ±8 V sweeping voltage. Analysis of the C-V and G-V results allows a quantification of the Coulomb charging energy and the trapped charge density associated with the charging/discharging behavior. It is found that the memory window is related to the size effect, and Si QDs with large size or low Coulomb charging energy can trap two or more electrons by changing the charging voltage. Meanwhile, the estimated lower potential barrier height between Si QD and a-SiC{sub x}, and the lower Coulomb charging energy of Si QDs could enhance the charging and discharging effect of Si QDs and lead to an enlarged memory window. Further studies of the charging/discharging mechanism of Si QDs embedded in a-SiC{sub x} can promote the application of Si QDs in low-power consumption semiconductor memory devices.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Influence of Cr on the nanoclusters formation and superferromagnetic behavior of Fe-Cr-Nb-B glassy alloys

High resolution imaging and electron diffraction confirm that in the as-quenched state the structure of Fe{sub 79.7−x}Cr{sub x}Nb{sub 0.3}B{sub 20} (x = 11–13 at. %) melt-spun ribbons is completely amorphous, independent of the Cr content. Energy-dispersive X-ray spectroscopy mapping emphasizes clearly the presence of Fe and Cr clusters varying from approximately 1 to 2–3 nm in size with the increase of Cr content from 11 to 13 at. %. The Fe and Cr atoms segregate the atomic scale to form nanometer sized clusters, influencing strongly the macroscopic magnetic behavior. The Curie temperature of the system, T{sub C}{sup system}, confirmed by the magnetic susceptibility versus temperature measurements, gives the strength of the magnetic interactions between clusters. The inter-cluster interactions are much stronger for lower contents of Cr, the microstructure is less uniform, and T{sub C}{sup system} increases from 290 K for 13 at. % Cr to 330 K for 11.5 at. % Cr. The whole system transforms to a ferromagnetic state through interactions between the clusters. Zero-field cooling and field cooling curves confirm the cluster behavior with a blocking temperature, T{sub b}, of about 250 K. Above T{sub b}, the ribbons behave as a superferromagnetic system, whilst below the blocking temperature a classical ferromagnetic behavior is observed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Low temperature magnetic and electrical transport behavior of Co{sub 58.5}Ga{sub 41.5} alloy

The electrical transport and magnetic properties of Co{sub 58.5}Ga{sub 41.5} binary alloy have been investigated in the temperature range 2-300 K. Analysis of field and temperatures dependence magnetization data suggests a reentrant magnetic behavior with Curie temperature (T{sub C}) ∼90 K. Temperature dependence of resistivity shows large residual resistivity values which is sensitive to the applied magnetic field. The temperature and field dependent resistivity behavior indicates the presence of spin fluctuations at low temperature. Magnetoresistance (MR) of 17 % has been observed at 2 K in 90 kOe field, which follows a power law with exponent varying form 0.5 at low temperature to linear behavior at higher temperature. The temperature variation of magnetization and MR can be understood on the basis of ferromagnetic matrix with finite spin clusters.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Perpendicular exchange bias behaviors of CoPt/IrMn and CoPt/FeMn bilayers: A comparative study

In this study, FeMn was introduced as an antiferromagnetic (AFM) layer to couple with a single-layered Co{sub 49}Pt{sub 51} alloy thin film, and it was compared with a Co{sub 49}Pt{sub 51}/IrMn bilayer system in exchange bias (EB) effect, to explore the mechanism of spontaneous perpendicular exchange bias (PEB), which has been recently observed in CoPt/IrMn bilayers. Bilayers of CoPt/IrMn and CoPt/FeMn were prepared under the same conditions by sputtering at room temperature without any inducing field. Although PEB was observed in as-grown CoPt/FeMn bilayers, the loop shape and PEB behavior were found to exhibit different characteristics from those of CoPt/IrMn bilayers. The CoPt (5 nm)/FeMn (10 nm) bilayer has a sheared loop that is similar to a double-shifted loop and a much lower squareness ratio (SQR = 0.52) and exchange bias field (H{sub e} = 180 Oe) than the CoPt (5 nm)/IrMn (10 nm) system, which has a rectangular loop shape and a high SQR of 0.97 and large H{sub e} of 290 Oe. The two systems present entirely different dependences of PEB on the thickness of the AFM layer. CoPt/IrMn exhibits behavior that is typical of most EB systems, but for CoPt/FeMn, this dependence is more complicated with an unusual peak at an AFM layer thickness of 10 nm. Based on the dissimilar loop shapes and dependences of PEB on AFM thickness, the mechanisms of the spontaneously established PEB in these two systems are considered to differ. Investigations of cross-sectional transmission electron microscopy revealed no apparent difference between the interfacial microstructures of the two systems. X-ray diffraction studies demonstrated the 〈111〉 texture of both systems. Therefore, different interfacial spin configurations may be responsible for the dissimilar PEB behaviors in these two FM/AFM bilayer systems.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Effects of feedstock availability on the negative ion behavior in a C{sub 4}F{sub 8} inductively coupled plasma

In this paper, the negative ion behavior in a C{sub 4}F{sub 8} inductively coupled plasma (ICP) is investigated using a hybrid model. The model predicts a non-monotonic variation of the total negative ion density with power at low pressure (10–30 mTorr), and this trend agrees well with experiments that were carried out in many fluorocarbon (fc) ICP sources, like C{sub 2}F{sub 6}, CHF{sub 3}, and C{sub 4}F{sub 8}. This behavior is explained by the availability of feedstock C{sub 4}F{sub 8} gas as a source of the negative ions, as well as by the presence of low energy electrons due to vibrational excitation at low power. The maximum of the negative ion density shifts to low power values upon decreasing pressure, because of the more pronounced depletion of C{sub 4}F{sub 8} molecules, and at high pressure (∼50 mTorr), the anion density continuously increases with power, which is similar to fc CCP sources. Furthermore, the negative ion composition is identified in this paper. Our work demonstrates that for a clear understanding of the negative ion behavior in radio frequency C{sub 4}F{sub 8} plasma sources, one needs to take into account many factors, like the attachment characteristics, the anion composition, the spatial profiles, and the reactor configuration. Finally, a detailed comparison of our simulation results with experiments is conducted.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Frequency-dependent ferroelectric behavior of BaMn3Ti4O14.25 at room temperature

We report the activation field and selective frequency-dependent ferroelectric behavior of BaMn3Ti4O14.25 (BMT-134) at room temperature. BMT-134, a recently discovered multiferroic complex oxide, exhibits antiferromagnetic and ferroelectric behavior and belongs to the hollandite crystal class. The microstructure can be manipulated through processing conditions to prepare a nanocrystalline textured tablet. We measured polarization-electric field (P-E) hysteresis loops and strain-electric field butterfly loops as a function of frequency in order to investigate the AC dynamics of domain switching and strain behavior. Under an electric field loading condition, a clear hysteresis loop of the electric field-displacement curve is obtained at 50 Hz, indicating that room temperature ferroelectricity is attainable under the right processing conditions. When the frequency is increased to 500 Hz, the coercive field also increases, until the frequency reaches 5 kHz, at which point the electric field versus electric displacement becomes linear indicating the limit of domain switching at high frequency.

Hossain, Muhammad E.↗

Microstructure of a-C:H films prepared on a microtrench and analysis of ions and radicals behavior

Amorphous carbon films (a-C:H) were prepared on a microtrench (4-μm pitch and 4-μm depth), and the uniformity of film thickness and microstructure of the films on the top, sidewall, and bottom surfaces of the microtrench were evaluated by scanning electron microscopy and Raman spectroscopy. The a-C:H films were prepared by bipolar-type plasma based ion implantation and deposition (bipolar PBII&D), and the negative pulse voltage, which is the main parameter dominating the film structure, was changed from −1.0 to −15 kV. Moreover, the behavior of ions and radicals was analyzed simultaneously by combining the calculation methods of Particle-In-Cell/Monte Carlo Collision (PIC-MCC) and Direct Simulation Monte Carlo (DSMC) to investigate the coating mechanism for the microtrench. The results reveal that the thickness uniformity of a-C:H films improves with decreasing negative pulse voltage due to the decreasing inertia of incoming ions from the trench mouth, although the film thickness on the sidewall tends to be much smaller than that on the top and bottom surfaces of the trench. The normalized flux and the film thickness show similar behavior, i.e., the normalized flux or thickness at the bottom surface increases at low negative pulse voltages and then saturates at a certain value, whereas at the sidewall it monotonically decreases with increasing negative voltage. The microstructure of a-C:H films on the sidewall surface is very different from that on the top and bottom surfaces. The film structure at a low negative pulse voltage shifts to more of a polymer-like carbon (PLC) structure due to the lower incident energy of ions. Although the radical flux on the sidewall increases slightly, the overall film structure is not significantly changed because this film formation at a low negative voltage is originally dominated by radicals. On the other hand, the flux of radicals is dominant on the sidewall in the case of high negative pulse voltage, resulting in a deviation from the Raman behavior of a-C:H films deposited by bipolar PBII&D. This tendency intensifies as the negative voltage becomes greater. Also, the energy of incident ions on the sidewall of the trench increases with increasing negative voltage, which causes a shift in the Raman data of the sidewall to the bottom right corner on the figure depicting the relationship of the FWHM(G) and the G-peak position, indicating increased graphitization of a-C:H film.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Polarization fluctuation behavior of lanthanum substituted Bi{sub 4}Ti{sub 3}O{sub 12} thin films

Polarization fluctuation behavior of lanthanum substituted Bi{sub 4}Ti{sub 3}O{sub 12} (Bi{sub 4−x}La{sub x}Ti{sub 3}O{sub 12}, BLT) ferroelectric thin films has been examined. Remnant polarization exhibits an initial increase (P{sub up}, 1–10{sup 6} cycles) and a subsequent decrease (P{sub down}, 10{sup 6}–10{sup 9} cycles) with switching cycles, whereas the dielectric constant exhibits a continuous decrease. By careful investigations on the effect of switching frequency and annealing atmosphere on the polarization fluctuation characteristics, we propose that this polarization fluctuation characteristic of BLT films is attributed to the competition between domain pinning and passive layer growing effect, due to the redistribution of oxygen vacancy related defect under external applied field. P{sub up} behavior is dominated by the unpinning of pinned domain, while P{sub down} behavior is dominated by the reduction of applied field on BLT bulk layer, due to the growing of the passive layer between BLT and Pt electrode. By assuming the dielectric constant and initial thickness of passive layer, the passive layer was estimated to be about 2–5 times thicker than the initial state after 10{sup 9} cycling.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Influence of axial self-magnetic field component on arcing behavior of spiral-shaped contacts

The transverse magnetic field (TMF) contact design is commonly used in vacuum interrupters. When arcing occurs between the TMF contacts, the contact structure can create a self-induced magnetic field that drives the arc to move and rotate on the contact, and thus local overheating and severe erosion can be avoided. However, TMF contacts could also create an axial self-magnetic component, and the influence of this component on the arc behavior has not been considered to date. In this paper, five different types of Cu-Cr spiral-shaped TMF contacts with three different structures are investigated in a demountable vacuum chamber that contains a high-speed charge-coupled device video camera. It was found that the contact structure greatly influenced the arc behavior, especially in terms of arc rotation and the effective contact area, while contacts with the same slot structure but different diameters showed similar arc behavior and arc motion. The magnetic field distribution and the Lorentz force of each of the three different contact structures are simulated, and the axial self-magnetic field was first taken into consideration for investigation of the TMF contact design. It was found that contact designs that have higher axial self-magnetic field components tend to have arc columns with larger diameters and show poorer arc motion and rotation performance in the experiments.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗