C-ADS中质子束窗散射效应和热力学计算

质子束窗是C-ADS中隔离加速器的真空环境与靶的非真空环境的重要部件。质子束窗材料及其冷却介质造成的束流散射效应是造成束流在靶外损失的主要因素,由于质子束窗中的高能量沉积和高辐照效应,束窗的热力学计算显得尤为重要。计算结果表明:当质子束窗和散裂靶距离为1.5 m时,通过选取合理的结构参数,多管道型质子束窗结构可以将靶外束流损失控制在1%以内。束窗中总的应力,包括由于温度升高造成的热应力、冷却剂的静压,以及束窗两侧加速器真空与外部非真空环境的压强差造成的应力,可以有效控制在所用材料的许用应力之内。并通过计算讨论给出C-ADS中质子束窗的初步设计参数。     

Crystal Morphology of High-Pressure Crystallized Bisphenol-A Polycarbonate

High-pressure crystallized bisphenol-A polycarbonate (BAPC) samples were investigated using wide-angle X-ray diffraction (WAXD), differential scanning calorimetry (DSC), and scanning electron microscopy (SEM). The results showed that BAPC chain-extended crystals with c-axis thickness around 2.0 μm were developed through the melt crystallization. Furthermore, a high-crystallinity BAPC sample with a wide variety of microstructures was obtained by a stepwise double-heat treatment at high pressure. In the sample, individual spherulites can be easily exposed and isolated with selective etching, which results in open porous microspheres. These spheres provide the possibility to study the spherulite structure in three dimensions. The open porous microspheres may have functional applications, such as catalyst support and for other surface active materials.     

Pyrolysis study of poplar biomass by tunable synchrotron vacuum ultraviolet photoionization mass spectrometry

Pyrolysis is one of the most important methods to convert biomass into biofuel, which is a potential substitute for fossil fuel. The pyrolysis process of poplar biomass, a potential biofuel feedstock, has been studied with tunable synchrotron vacuum ultraviolet (SVUV) photoionization mass spectrometry (PIMS). The mass spectra at different photon energies, temperatures, and time-evolved profiles of selected species during poplar pyrolysis process were measured. Our results reveal that poplar is typical of hardwood according to its relative contents of three lignin monomeric precursors. As temperature increases from 300 to 700 °C, the overall intensities of pyrolysis products decrease due to the gas-phase cracking. Observed intensities of syringyl and guaiacyl subunits of lignin in poplar at low temperature present different trends: the intensities of syringyl subunits of lignin undergo an increase firstly and then a decrease, whereas those of guaiacyl subunits of lignin show decrease continuously. Time-dependent data demonstrate that hemicellulose pyrolysis is faster than lignin in poplar. This work reports a new application of SVUV PIMS in biomass pyrolysis, which performs very well in products analysis.     

Penetrating view of nano-structures in Aleochara verna spermatheca and flagellum by hard X-ray microscopy

A penetrating view of the three-dimensional nanostructure of female spermatheca and male flagellum in the species Aleochara verna is obtained with 100-nm resolution using a hard X-ray microscope, which provides a fast noninvasive imaging technology for insect morphology. Through introducing Zernike phase contrast and heavy metal staining, images taken at 8 keV displayed sufficient contrast for observing nanoscale fine structures, such as the spermatheca cochleate duct and the subapex of the flagellum, which have some implications for the study of the sperm transfer process and genital evolution in insects. This work shows that both the spatial resolution and the contrast characteristic of hard X-ray microscopy are quite promising for insect morphology studies and, particularly, provide an attractive alternative to the destructive techniques used for investigating internal soft tissues.     

Impact of the CoFe microstructure etched surface oxidation on Co spin and orbital moment

Patterned ferromagnetic thin film shows promising applications in ultra-high density magnetic storage,magnetoresistive transducer,magnetic random access memory and many other devices.Since the performance of these devices is closely associated with the magnetic properties of the etched patterns,it is necessary to study the effects of freshly etched surface oxidation on the magnetic properties of the patterned microstructures.In the current work,were carried out an X-ray Magnetic Circular Dichroism(XMCD) study on a 50 nm Co 0.9 Fe 0.1 continuous thin film and a related patterned Co 0.9 Fe 0.1 grating structure etched with a 2 μm period.Based on the sum rules,the spin and orbital moments were calculated for these two samples,respectively.The results indicated that the spin and orbital moments of grating structure(1.34μ B and 0.24μ B,respectively) decreased 17.3% compared with the corresponding continuous film(1.62μ B and 0.29μ B,respectively).We proposed that the moment decreasing of the patterned grating structure was mainly caused by the etched surface oxidation during the pattern manufacture process.The oxidation ratio of Co element in the patterned grating structure is 14.4% calculated from X-ray absorption spectroscopy(XAS) measurement.Considering the oxidation ratio,we amend the spin and orbital moment of Co and the amended result is basically in accordance with that of continuous film,demonstrating that the difference of the spin and orbital moments between the sub-micron grating unit and the continuous film is really caused by the oxidation.     

Local hydrated structure of an Fe2+/Fe3+ aqueous solution: an investigation using a combination of molecular dynamics and X-ray absorption fine structure methods

The hydrated shell of both Fe2+ and Fe3+ aqueous solutions are investigated by using the molecular dynamics (MD) and X-ray absorption structure (XAS) methods. The MD simulations show that the first hydrated shells of both Fe2+ and Fe3+ are characterized by a regular octahedron with an Fe-O distance of 2.08 for Fe2+ and 1.96 for Fe3+, and rule out the occurrence of a Jahn-Teller distortion in the hydrated shell of an Fe2+ aqueous solution. The corresponding X-ray absorption near edge fine structure (XANES) calculation successfully reproduces all features in the XANES spectra in Fe2+ and Fe3+ aqueous solution. A feature that is located at energy 1 eV higher than the white line (WL) in an Fe3+ aqueous solution may be assigned to the contribution of the charge transfer.     

Pressure-induced phase transitions of multiferroic BiFeO3

Pressure-induced phase transitions of multiferroic BiFeO3 have been investigated using synchrotron radiation X-ray diffraction with diamond anvil cell technique at room temperature. Present experimental data clearly show that rhombohedral （R3c） phase of BiFeO3 first transforms to monoclinic （C2/m） phase at 7 GPa, then to orthorhombic （Pnma） phase at 11 GPa, which is consistent with recent theoretical ab initio calculation. However, we observe another peak at 2θ=7° in the pressure range of 5-7 GPa that has not been reported previously. Further analysis reveals that this reflection peak is attributed to the orthorhombic （Pbam） phase, indicating the coexistance of monoclinic phase with orthorhombic phase in low pressure range.     

Spectral calibration of filters and detectors of solar telescope at a wavelength of 13.2 nm for the TESIS project

The telescope at a wavelength of 13.2 nm of the TESIS device of the CORONAS-PHOTON satellite is intended for imaging hot plasma (T ～ 10 MK) of the solar corona. In this paper, calibration of optical elements of the telescope is described. The transmittance of multilayer Zr/Si filters and the sensitivity and radiation resistance of the CCD-array-based detector were measured. The transmittance of filters in the operating wavelength range was 40–50% (for filters of various thicknesses); the spectral dependence of the transmittance was close to the calculated one. The transmittance of filters in the visible region was (1–2) × 10^?6. The detector sensitivity was 0.01–0.1 analog-to-digital units per photon (adu/photon), the radiation resistance was better than 10⁹ rad.     

X-ray absorption spectroscopy study of the electronic structure and local coordination of 1st row transition metal-promoted Chevrel-phase sulfides

Abstract

The electronic structures of S and Mo as well as the local coordination of Mo are investigated as a function of metal promotion Chevrel-phase (CP) sulfides. We observe the effect of metal promoter-induced electron donation into the stoichiometric range M_xMo₆S₈ (M?=?Fe, Ni, Cu; x?=?0–2) through analysis of X-ray absorption near-edge structure regions. We further observe the effect of this promotion on the bonding environment of Mo₆ metal centers through extended X-ray absorption fine structure analysis. We monitor expansion and contraction of Mo₆ octahedra with and without metal promotion, as has been predicted by Hückel molecular orbital theory. We further observe a marked tunability in the electronic structure of sulfur upon charge transfer between promoting species and Mo₆S₈ units. Average Mo₆ octahedron Mo–Mo bond contraction from 2.76 Å to as short as 2.69 Å was observed upon incorporation of metal promoters, while intercluster separation displays a pronounced increase for promoter-host lattices compared to un-promoted Mo₆S₈. To corroborate spectroscopically observed phenomena, we performed computational analyses of spin-polarized densities of state for the CP materials investigated herein, where a detectable increase in sulfur-based frontier orbital population is observed in accordance with experimentally validated orbital filling.     

Photoionization and Dissociation Study of 2-Methyl-2-propen-1-ol: Experimental and Theoretical Insights

The photoionization and dissociation of 2-methyl-2-propen-1-ol (MPO) have been investigated by using molecular beam experimental apparatus with tunable vacuum ultravioletsynchrotron radiation in the photon energy region of 8.0-15.5 eV. The photoionization efficiency (PIE) curves for molecule ion and fragment ions: C₄H₈O⁺、C₄H₇O⁺、C₃H₅O⁺、C₄H₇⁺、C₄H₆⁺、C₄H₅⁺、C₂H₄O⁺、C₂H₃O⁺、C₃H₆⁺、C₃H₅⁺、C₃H₃⁺、CH₃O⁺、CHO⁺ have been measured, and the ionization energy (IE) and the appearance energies (AEs) of the fragment ions have been obtained. The stable species and the first order saddle points have been calculated on the CCSD(T)/cc-pvTZ//B3LYP/6-31+G(d,p) level. With combination of theoretical and experimental results, the dissociative photoionization pathways of 2-methyl-2-propen-1-ol are proposed. Hydrogen migrations within the molecule are the dominant processes in most of the fragmentation pathways of MPO.