The influence of different fabrication processes on characteristics of excess Bi2O3-doped 0.95 (Na0.5Bi0.5)TiO3–0.05 BaTiO3 ceramics

In this study, we will develop the influences of the excess x wt% (x=0, 1, 2, and 3) Bi₂O₃-doped and the different fabricating process on the sintering and dielectric characteristics of 0.95 (Na_0.5Bi_0.5)TiO₃–0.05 BaTiO₃ ferroelectric ceramics with the aid of SEM and X-ray diffraction patterns, and dielectric–temperature curves. The 0.95 (Na_0.5Bi_0.5)TiO₃–0.05 BaTiO₃+x wt% Bi₂O₃ ceramics are fabricated by two different processes. The first process is that (Na_0.5Bi_0.5)TiO₃ composition is calcined at 850 °C and BaTiO₃ composition is calcined at 1100 °C, then the calcined (Na_0.5Bi_0.5)TiO₃ and BaTiO₃ powders are mixed in according to 0.95 (Na_0.5Bi_0.5)TiO₃–0.05 BaTiO₃+x wt% Bi₂O₃ compositions. The second process is that the raw materials are mixed in accordance to the 0.95 (Na_0.5Bi_0.5)TiO₃–0.05 BaTiO₃+x wt% Bi₂O₃ compositions and then calcining at 900 °C. The sintering process is carried out in air for 2 h from 1120 to 1240 °C. After sintering, the effects of process parameters on the dielectric characteristics will be developed by the dielectric–temperature curves. Dielectric–temperature properties are also investigated at the temperatures of 30–350 °C and at the frequencies of 10 kHz–1 MHz.     

Detecting Higgs bosons with muons at hadron colliders

We investigate the prospects for the discovery of neutral Higgs bosons with a pair of muons by direct searches at the CERN large hadron collider (LHC) as well as by indirect searches in the rare decay Bs→μ⁺μ⁻$B_s\to {\mu }^{+}{\mu }^{-}$ at the Fermilab Tevatron and the LHC. Promising results are found for the minimal supersymmetric standard model, the minimal supergravity (mSUGRA) model, and supergravity models with non-universal Higgs masses (NUHM SUGRA). For tanβ?50$\tan \beta ?50$, we find that (i) the contours for a branching fraction of B(Bs→μ⁺μ⁻)=1×¹⁰⁻⁸$B(B_s\to {\mu }^{+}{\mu }^{-})=1\times {10}^{\mathrm{-8}}$ in the parameter space are very close to the 5σ   contours for pp→b?⁰→bμ⁺μ⁻+X$pp\to b{?}^0\to b{\mu }^{+}{\mu }^{-}+X$, ?⁰=h⁰${?}^0=h^0$, H⁰$H^0$, A⁰$A^0$ at the LHC with an integrated luminosity (L) of 30 fb⁻¹, (ii) the regions covered by B(Bs→μ⁺μ⁻)?5×¹⁰⁻⁹$B(B_s\to {\mu }^{+}{\mu }^{-})?5\times {10}^{\mathrm{-9}}$ and the discovery region for b?⁰→bμ⁺μ⁻$b{?}^0\to b{\mu }^{+}{\mu }^{-}$ with 300 fb⁻¹ are complementary in the mSUGRA parameter space, (iii) in NUHM SUGRA models, a discovery of B(Bs→μ⁺μ⁻)?5×¹⁰⁻⁹$B(B_s\to {\mu }^{+}{\mu }^{-})?5\times {10}^{\mathrm{-9}}$ at the LHC will cover regions of the parameter space beyond the direct search for b?⁰→bμ⁺μ⁻$b{?}^0\to b{\mu }^{+}{\mu }^{-}$ with L=300 fb⁻¹$L=300{\text{fb}}^{\mathrm{-1}}$.     

Solving Location-allocation Problems with Rectilinear Distances by Simulated Annealing

The objective of this study is to use the simulated annealing method to solve minisum location-allocation problems with rectilinear distances. The major advantage of the simulated annealing method is that it is a very general and efficient algorithm for solving combinatorial optimization problems with know objective functions. In this study, a simulated annealing algorithm was developed to solve the location-allocation problems, and its performance was compared with two other popular methods for solving location-allocation problems. The results show that simulated annealing is a good alternative to the two methods, as measured by both the solution quality and the computational time.     

Workshop on in‐situ studies of materials processing

More than eighty scientists from over ten different countries in Europe and America descended on Diamond Light Source in Oxfordshire to participate in the International Workshop on X-ray Spectroscopy of Magnetic Solids on June 10–21, 2010. The XRMS meetings have demonstrated to be a fruitful forum for informal discussion of recent results and future projects of synchrotron-radiation-based research on magnetism and also serve for the formation of new collaborations. The meetings are organized in sessions dedicated to specific scientific topics and experimental techniques. The absence of parallel sessions allows all the participants to take part in the discussion and to have a comprehensive view of the latest achievements and of the envisioned developments in the field. The previous meeting in the series was held last year at the synchrotron Soleil in St Aubin near Paris. The emerging new opportunities for magnetic spectroscopy, such as offered by the beamline for advanced dichroism experiments (BLADE), with its three intertwined assets of polarization, coherence, and time resolution, made it timely for the international community to convene at Diamond.     

Effect of nucleobase sequence on the proton-transfer reaction and stability of the guanine-cytosine base pair radical anion

The formation of base pair radical anions is closely related to many fascinating research fields in biology and chemistry such as radiation damage to DNA and electron transport in DNA. However, the relevant knowledge so far mainly comes from studies on isolated base pair radical anions, and their behavior in the DNA environment is less understood. In this study, we focus on how the nucleobase sequence affects the properties of the guanine-cytosine (GC) base pair radical anion. The energetic barrier and reaction energy for the proton transfer along the N(1)(G)-H···N(3)(C) hydrogen bond and the stability of GC˙(-) (i.e., electron affinity of GC) embedded in different sequences of base-pair trimer were evaluated using density functional theory. The computational results demonstrated that the presence of neighboring base pairs has an important influence on the behavior of GC˙(-) in the gas phase. The excess electron was found to be localized on the embedded GC and the charge leakage to neighboring base pairs was very minor in all of the investigated sequences. Accordingly, the sequence behavior of the proton-transfer reaction and the stability of GC˙(-) is chiefly governed by electrostatic interactions with adjacent base pairs. However, the effect of base stacking, due to its electrostatic nature, is severely screened upon hydration, and thus, the sequence dependence of the properties of GC˙(-) in aqueous environment becomes relatively weak and less than that observed in the gas phase. The effect of geometry relaxation associated with neighboring base pairs as well as the possibility of proton transfer along the N(2)(G)-H···O(2)(C) channel have also been investigated. The implications of the present findings to the electron transport and radiation damage of DNA are discussed.     

Structural stability–chromatographic retention relationship on exenatide diastereomer separation

In this study, the relationship of the structural stability of peptide diastereomers in elution solvents and their retention behaviors in reversed-phase chromatography (RPC) was examined to provide guidance on the solvent selection for a better separation of peptide diastereomers. We investigated the chromatographic retention behaviors of exenatide, a peptide drug for the treatment of type II diabetes mellitus and its three diastereomers using RPC and implicit molecular dynamics (MD) simulation analysis. Three diastereomers involved in the single serine residue mutation of d-form at the 11th, 32nd, and 39th residues were investigated in this study. Results show that the order of the solution structural stability of exenatide and its diastereomers is consistent with their retention order by 36?% acetonitrile/water elution. The sample loading solvent also affects the retention behaviors of exenatide peptide diastereomers in RPC column. Furthermore, a larger solution conformation energy difference of the critical pair of exenatide and its diastereomer (d-Ser39) at the elution solvent of 32?% tetrahydrofuran/water were obtained by MD simulation, and baseline separation was proved experimentally. In summary, we demonstrated that the solution structural stability–chromatographic retention relationship could be a powerful tool for elution solvent selection in peptide chromatographic purification, especially valuable for the separation of critical pair of diastereomers.

Electron tunneling pathways and role of adenine in repair of cyclobutane pyrimidine dimer by DNA photolyase

Electron tunneling pathways in enzymes are critical to their catalytic efficiency. Through electron tunneling, photolyase, a photoenzyme, splits UV-induced cyclobutane pyrimidine dimer into two normal bases. Here, we report our systematic characterization and analyses of photoinitiated three electron transfer processes and cyclobutane ring splitting by following the entire dynamical evolution during enzymatic repair with femtosecond resolution. We observed the complete dynamics of the reactants, all intermediates and final products, and determined their reaction time scales. Using (deoxy)uracil and thymine as dimer substrates, we unambiguously determined the electron tunneling pathways for the forward electron transfer to initiate repair and for the final electron return to restore the active cofactor and complete the catalytic photocycle. Significantly, we found that the adenine moiety of the unusual bent flavin cofactor is essential to mediating all electron-transfer dynamics through a superexchange mechanism, leading to a delicate balance of time scales. The cyclobutane ring splitting takes tens of picoseconds, while electron-transfer dynamics all occur on a longer time scale. The active-site structural integrity, unique electron tunneling pathways, and the critical role of adenine ensure the synergy of these elementary steps in this complex photorepair machinery to achieve maximum repair efficiency which is close to unity. Finally, we used the Marcus electron-transfer theory to evaluate all three electron-transfer processes and thus obtained their reaction driving forces (free energies), reorganization energies, and electronic coupling constants, concluding that the forward and futile back-electron transfer is in the normal region and that the final electron return of the catalytic cycle is in the inverted region.     

Four-wave mixing between a soliton and noise in a system with large amplifier spacing

Depletion of soliton energy by four-wave mixing between a soliton and amplifier noise in a system with 100-km amplifier spacing is studied. Dispersion exponentially decreasing fiber is used as transmission fiber. Improvement of the system by the use of a sliding-frequency filter to reduce noise power and the depletion of soliton energy is shown. The system can be further improved by compensation for depleted soliton energy.     

Electrochemical behaviour of oxygen at nickel nest cathodic material with catalyst La1−xSrxCoO3

The reduction of oxygen in the three phases gas–liquid–solid using a nickel nest as electrode with a La_1−xSr_xCoO₃ (x=0, 0.3, 0.5, 0.7, 1) series of combined oxides as a catalyst in different electrolytes of acidic H₃PO₄ or alkaline KOH, NaOH or LiOH solution at a fixed optimum oxygen flow-rate at room temperature was studied by the electrochemical method. The electrochemical parameters, such as electron transfer coefficient and exchange current density, were also determined. The La_1−xSr_xCoO₃ series of catalysts was synthesized by a solid-state reaction. XRD was used to confirm the structure of the catalyst. BET, EDS and resistivity measurements were used to investigated the electrochemical behaviour of the cathodic reduction of oxygen in the presence of the catalyst. SEM was also used to inspect the change before and after the reaction with the catalyst. The electron transfer coefficients, β, from the experiments with the various catalysts in the different alkaline electrolytes were determined as follows:

β(in KOH)>β(in NaOH)>β(in LiOH).

It was discovered that La_0.7Sr_0.3CoO₃ as a catalyst has a higher catalytic activity, a higher specific surface area, lower electrical resistivity, better stability and less agglomeration. Therefore, the above catalyst is the best catalyst for oxygen reduction of those studied.