Electronic structure and absolute band edge position of tetragonal AgInS2 photocatalyst: A hybrid density functional study

Energy bands, effective mass of carriers, absolute band edge positions and optical properties of tetragonal AgInS₂ were calculated using a first-principles approach with the exchange correlation described by B3LYP hybrid functional. The results indicate that tetragonal AgInS₂ has a direct band gap of 1.93 eV, which reproduce well experimental value. Calculated effective masses of electrons and holes are both small which are beneficial to separation and migration of electron and hole pairs. This implies that AgInS₂ has good photocatalytic performance. The calculated optical characteristics indicate that AgInS₂ has a slight anisotropy for both the real and imaginary parts of the dielectric function and exhibits large optical absorption in the visible light region. Furthermore, the calculated band edge positions in (100), (010) and (001) surfaces indicate that tetragonal AgInS₂ is beneficial to the reduction and oxidation of water to hydrogen and oxygen under visible light irradiation.     

Monomer casting nylon-6-b-polyether amine copolymers: Synthesis and properties

MC nylon-6-b-polyether amine copolymers were prepared with macro-initiator based on amino-terminated polyether amine functionalized with isocyanate via in-situ polymerization. It was found that the introduction of polyether amine delayed the polymerization process of caprolactam by increasing apparent activation energy and pre-exponential factor, resulting in the decrease of molecular weight of nylon-6. The motion of molecular chain of the copolymers was easy because of the decreased hydrogen bonds and weakened inter-molecular forces. The physical entanglement of molecular chains of the copolymers was significant and strong which increased the entanglement density. Only the nylon-6 phase crystallized in the copolymers and the crystal grain size, spherulite size and crystallinity of the copolymers decreased. A small amount of γ crystal formed at high polyether amine content. The copolymers presented obvious strain hardening behavior in stress-strain curves and the loss factor dramatically increased while the glass transition temperature and storage module decreased. The fracture surface of the copolymers became rough and presented hairy structure, indicating that the toughening mechanism of the copolymers corresponded to the multi-layer crack extension mechanism.     

Controlling Au electrode patterns for simultaneously monitoring electrical actuation and shape recovery in shape memory polymer

This paper presents an effective approach to achieve efficient electrical actuation and monitoring of shape recovery based on patterned Au electrodes on shape memory polymer (SMP). The electrically responsive shape recovery behavior was characterized and monitored by the evolution change in electrical resistance of patterned Au electrode. Both electrical actuation and temperature distribution in the SMP have been improved by optimizing the Au electrode patterns. The electrically actuated shape recovery behavior and temperature evolution during the actuation were monitored and characterized. The resistance changes could be used to detect beginning/finishing points of the shape recovery. Therefore, the Au electrode not only significantly enhances the electrical actuation performance to achieve a fast electrical actuation, but also enables the resistance signal to detect the free recovery process.     

Decomposition of first-order hybrid Petri nets for hierarchical control of manufacturing systems

Although hybrid Petri net (HPN) is a popular formalism in modelling hybrid production systems, the HPN model of large scale systems gets substantially complicated for analysis and control due to large dimensionality of such systems. To overcome this problem, a typical approach is to decompose the net into subnets and then control the plant through hierarchical or decentralized structures. Although this concept has been widely discussed in the literature for discrete PNs, there is a lack of research for HPNs. In this paper, a new method of decomposition of first-order hybrid Petri nets (FOHPNs) is proposed first and then the hierarchical control of the subnets through a coordinator is introduced. The advantage of using the proposed approach is validated by an existing example. A sugar milling case study is analysed by using a decomposed FOHPN model and the optimization results are compared against the results of the approaches presented in other papers. Simulation results show not only an improvement in production rate, but also show the ability to control the plant online. In addition, by using the hierarchical control structure for an FOHPN model, it is possible to reduce the cost of communication links, improve the reliability of the system, maintain the plant locally, and partially redesign the system.     

Investigations on grinding process of woven ceramic matrix composite based on reinforced fiber orientations

Fiber orientations play the decisive role in grinding process of woven ceramic matrix composites, but the influence of woven fibers in grinding process is not clear. This paper studies the surface quality and grinding force by comparing different woven surfaces. Through a series of experiments in optimized sampling conditions, we analyze characteristics of the material surface topography height, wave distribution and surface support properties in details. And we find some outstanding characteristics of the surface microstructure. We also study the influence of grinding processing parameters on surface microstructure. The results show that machining surface which contains more parallel fibers is rougher and more keenness than gauss surface. Grinding wheel speed and depth of cut have great influence on surface topography and surface support properties. And it is discovered that grinding forces are also highly dependent on fiber orientations. The mechanism of the grinding phenomena is also analyzed in this paper according to knowledge of fracture mechanics and mechanical damage phenomenology. The research obtained will be an important technical support on improving the processing quality of woven ceramic matrix composites.     

Novel organic dyes containing N-bridged oligothiophene coplanar cores for dye-sensitized solar cells

Three novel organic dyes adopting fully-fused coplanar heteroarene as the donor moieties end-capped with two cyanoacrylic acids as acceptors and anchoring groups have been synthesized, characterized, and used as the sensitizers for dye-sensitized solar cells (DSSCs). The photophysical and electrochemical properties of the novel dyes and the characteristics of the DSSCs based on the novel organic dyes were investigated. The incorporation of the coplanar cores with electron-donating N-bridges are beneficial for the better intramolecular charge transfer (ICT), giving these new dyes good light-harvesting capability. The LUMO energy levels of these coplanar heteroacene-based dyes are sufficiently high for the efficient electron injection to TiO₂ upon photo-excitation, while the suitable HOMOs allow the regeneration of oxidized dyes with the electrolyte redox (I⁻/I₃⁻). The structural features of the coplanar cores (penta vs. hexa heteroarene) as well as the alkyl substitutions play crucial roles in governing the physical properties and device performance. Among these three novel organic sensitizers, the EHTt dye composed of a fully fused hexa-arene core and less bulky N-alkyl groups caused the DSSC to show the best photovoltaic performance with an open-circuit voltage (V_OC) of 0.58 V, a short-circuit photocurrent density (J_SC) of 13.72 mA/cm², and a fill factor (FF) of 0.69, yielding an overall power conversion efficiency (PCE) of 5.52% under AM 1.5G solar irradiation.     

Hierarchical electromagnetic absorption in micro-waveguide stuffed with magnetic media for resin-based composites of graphene nanosheets and manganese oxides

Waveguide configurations of hierarchical system are proposed as new microstructures for composites in absorbing enhancement. Supercritical fluid (SCF) one-pot exfoliation of layered graphite and manganese oxide mixing materials is developed to obtain a hierarchical system, containing graphene nanosheets (GNS) and exfoliated manganese oxides (EMO) in different sizes. Composites with GNS–EMO embedded in epoxy resin matrix are produced for a design of dielectric and magnetic loss integrated absorber. Volume fraction of GNS–EMO in composites is given for an optimal quantity of resin epoxy in fixation and formation. The effect of mixing ratios between electric and magnetic components is provided for the design of dielectric and magnetic loss integrated absorbers. Frequency shifting phenomena are revealed in the component adjusting course. Excluding the offsetting sizes, reflection loss of composites is enhanced as thickness increases. Synergistic effect of electric and magnetic coordinated materials demonstrates the superiority of micro-waveguide structures in GNS–EMO composite absorber.     

Characteristics and formation mechanism of porosities in CFRP during laser joining of CFRP and steel

An experimental investigation on the mechanism of porosity formation during the laser joining of carbon fiber reinforced polymer (CFRP) and steel is presented. The porosity morphology and distribution were characterized by optical and scanning electron microscopy, and the thermal pyrolysis behaviors were investigated by thermal analysis and designed back-side cooling experiments. The results show that there are two types of porosities in CFRP. Porosity I only appears when the heat input is more than 77.8 J/mm. It has a smooth inner wall and distributes near the bonding interface between CFRP and steel at the central area of melted zone, which is caused by gaseous products such as CO₂, NH₃, H₂O, and hydrocarbons produced by the pyrolysis of CFRP. Porosity II can be seen under all joining conditions. It has a rough inner wall and distributes far away from the bonding interface, concentrating at the final solidification locations. Porosity II is caused by the shrinkage of melted CFRP during solidification stage.     

Value chain analysis of bio-coal business in Finland: Perspectives from multiple value chain members

The purpose of this study is to provide a comprehensive outline of the Value Chain (VC)¹ of bio-coal in Finland, define the proper business models of bio-coal business, and investigate the interrelationships between VC activities. The major findings are: 1) the study found significant interrelationships between support and primary activities in the bio-coal VC which suggest that we should not emphasis only the core value/primary activities of the bio-coal business, but pay more attentions to the “side values”/support activities; 2) The study identified political and environmental factors as the effective drivers, while technology and cost-profit uncertainty as major restrictions for the Finnish bio-coal business. The authors would like to suggest that instead of purely “environmental concerns”, the term “sustainability credentials” should be emphasized, which means value creating and adding items should not limit to monetary values, but consider social and environmental value propositions. 3) The study identified “low competition” in the current bio-coal business in Finland, which implies opportunities of market entrance for Finnish and international companies; 4) The study identified that the current Finnish bio-coal model is the decentralized model at the local level. However, the future Finnish bio-coal model will be a large scaled model, with a focus on export sales.     

Top illuminated organic photodetectors with dielectric/metal/dielectric transparent anode

The top illuminated organic photodetectors (OPDs) with a Dielectric/Metal/Dielectric (DMD) transparent anode are fabricated. The transparent electrode is composed of molybdenum trioxide (MoO₃)/silver (Ag)/MoO₃ layers and zinc oxide (ZnO)/aluminum (Al) is used for bottom cathode. The optimized DMD electrode has an optical transmittance of 85.7% at the wavelength of 546 nm and sheet resistance of ∼6 Ω/sq. The fabricated OPDs exhibit a high detectivity and wide range linearity.