A framework for mapping the RFID-enabled process redesign in a simulation model

Empowered by the possibility to automatically identify unique product instances, the Radio Frequency Identification (RFID) technology is expected to revolutionize the supply chain processes. However, in view of the numerous possible ways that RFID can be implemented within the supply chain, the issue of supporting the design choices based on a credible assessment between the current (as-is) and the future (to-be) processes has become a matter of considerable concern and debate for both practitioners and academics alike. To design RFID implementations in the supply chain using a robust dynamic analysis, we resort to discrete event simulation. As a result, this paper conceptualizes the ‘RFID-enabled process redesign’ and proposes a framework regarding all possible types of RFID effects when integrating the technology within the supply chain processes. The research design was based on the empirical evidence through three case studies combined with the development of simulation models and on theoretical constructs regarding the information technology (IT)-enabled process redesign.     

Function solutions to certain Diophantine equations

We investigate whether certain Diophantine equations have or have not solutions in entire or meromorphic functions defined on a non-Archimedean algebraically closed field of characteristic zero. We prove that there are no non-constant meromorphic functions solving the Erdös–Selfridge equation except when the corresponding curve is a conic. We also show that there are infinitely many non-constant entire solutions to the Markoff–Hurwitz equation.     

Investigation of symmetries of second-order nonlinear susceptibility tensor of GaSe crystals in THz domain

Following our measurements and analysis made on several GaSe crystals, we demonstrated that terahertz (THz) generation from ultrafast laser pulses can be developed into a sensitive technique for investigating symmetries of second-order nonlinear susceptibility tensor of a nonlinear crystal. Indeed, for GaSe crystals, both Kleinman's symmetry condition and spatial symmetry were violated due to the contribution of ionic displacement to nonlinear polarization and deviation of GaSe lattice from hexagonal symmetry. When the pump photon energy was increased from that below the bandgap of GaSe to that above it, the mechanism for the THz generation was switched from optical rectification to photocurrent surge.     

Investigation of terahertz generation from passively Q-switched dual-frequency laser pulses

When two Nd:YLF crystals share a Cr:YAG crystal functioning as a single passive Q switch, the timing jitter between each pair of dual-frequency pulses generated by the two crystals has been reduced by a factor of 20. Such a reduction in the timing jitter allows us to generate terahertz pulses by focusing such a passively Q-switched laser beam onto a nonlinear crystal. Such a result represents the first step for us to eventually implement a compact terahertz source based on ultracompact microchip lasers.     

Efficient full Newton–Raphson technique for the solution of molecular integral equations – example of the SPC/E water-like system

It is shown how a full Newton–Raphson technique speeds up in impressive proportions the iterative resolution of molecular integral equations and makes it possible to reach quadratically complete convergence down to machine precision in a very few cycles. The technique generalises what has been originally proposed by Zerah and extensively used since then with great success for various fluids and mixtures of spherical objects. At each main iteration, the linearised cycle obtained by differentiating the Ornstein–Zernike and the integral equations is itself solved iteratively in terms of Δg^mnl_μν(r) projections. Its solution is reached very rapidly thanks to the powerful biconjugate gradient method and to the absence of any Euler angle manipulation. The virial equation is written in a shape formally different from the standard one, which allows a much higher numerical precision for the pressure without extra numerical work. The complete scheme is illustrated on the popular SPC/E water model.     

Efficient frequency upconversion of coherent radiation from 10.26 to 1.187 μm in a GaSe crystal

Frequency upconversion of laser pulses at 10.26 μm to those at 1.187 μm was achieved in the presence of Nd:YAG laser pulses based on difference-frequency generation in a 10 mm-long GaSe crystal. The highest power conversion efficiency for the parametric conversion was determined to be 20.9%, corresponding to the photon conversion efficiency of 2.42%. This value is two orders of magnitude higher than the highest value reported on GaSe in the literature. The saturation of the output power at 1.187 μm as the input power at 10.26 μm was increased, due to the back conversion, i.e. 1.187 μm + 10.26 μm → 1.064 μm, was clearly evidenced. Such a parametric process has potential for achieving sensitive detections of mid-infrared radiation.     

Crystal Structures of the Inclusion Complexes of β-Cyclodextrin with Aliphatic Monoacids Tridecanoic Acid and (Z)-Tetradec-7-enoic Acid. Formation of [3]Pseudorotaxanes

The structures of the inclusion complexes of beta cyclodextrin with the aliphatic mono-acids tridecanoic acid (1) and (Z)-tetradec-7-enoic acid (2) have been determined at room temperature. Both compounds crystallise in P1, a = 15.654(6) Å, b = 15.650(6) Å, c = 15.937(6) Å, = 101.58(1)°, = 101.59(1)°, = 103.58(1)°, Z = 1, for 1 and a = 15.6259(9) Å, b = 15.623(1) Å, c = 15.935(1) Å, = 101.547(2)°, = 101.555(2)°, = 103.642(2)°, Z = 1, for 2. One molecule of the monoacids threads through two cyclodextrin macrocycles arranged in dimers thus forming [3]pseudorotaxanes. The host dimers are aligned along a channel in order to create a hydrophobic environment for the terminal methyl group of the guest and isolate it from the aqueous environment that surrounds the cyclodextrin dimeric units. The guests exhibit disorder over two orientations resulting in hydrogen bonding between the carboxyl groups of adjacent guest molecules along the channel and formation of carboxylic dimers. This crystal packing differs from that of -CD complexes of homologous dicarboxylic acids.     

Second-order nonlinear optical materials for efficient generation and amplification of temporally-coherent and narrow-linewidth terahertz waves

We have considered forward and backward optical parametric oscillation and amplification, and difference-frequency generation for efficiently generating and amplifying terahertz waves in several second-order nonlinear optical materials. We have used a single crystal of CdSe as an example. We have also investigated GaSe, periodically-poled LiNbO₃ and LiTaO₃, and diffusion-bonded-stacked GaAs and GaP plates. The advantage of using birefringence in CdSe and GaSe is tunability of the output terahertz frequency. Furthermore, both CdSe and GaSe can be used to achieve the backward parametric oscillation without any cavity. On the other hand, in periodically-poled LiNbO₃ and LiTaO₃, one can take advantage of large diagonal elements of second-order nonlinear susceptibility tensor. In the diffusion-bonded-stacked GaAs and GaP plates, quasi-phase matching can be achieved by alternatively rotating the plates. We have shown that it is feasible to achieve forward optical parametric oscillation in the THz domain using these plates. The advantage of using coherent parametric processes is possibility of efficiently generating and amplifying temporally-coherent and narrow-linewidth terahertz waves. Compared with a noncollinear configuration, by using the parallel wave propagation configurations, the conversion efficiency can be higher because of longer effective interaction length among all the waves.     

Reconciling Electrostatic and n→π* Orbital Contributions in Carbonyl Interactions

Interactions between carbonyl groups are prevalent in protein structures. Earlier investigations identified dominant electrostatic dipolar interactions, while others implicated lone pair n→π* orbital delocalisation. Here these observations are reconciled. A combined experimental and computational approach confirmed the dominance of electrostatic interactions in a new series of synthetic molecular balances, while also highlighting the distance‐dependent observation of inductive polarisation manifested by n→π* orbital delocalisation. Computational fiSAPT energy decomposition and natural bonding orbital analyses correlated with experimental data to reveal the contexts in which short‐range inductive polarisation augment electrostatic dipolar interactions. Thus, we provide a framework for reconciling the context dependency of the dominance of electrostatic interactions and the occurrence of n→π* orbital delocalisation in C=O???C=O interactions.