层状钙钛矿结构锰氧化物Ca3Mn2O7的压致结构相变

采用金刚石压砧高压装置(DAC),对层状钙钛矿结构锰氧化物Ca     

Compression Behaviour of Ni77P23 Amorphous Alloy up to 30.5 GPa

The compression behaviour of Ni77P23 amorphous alloy is investigated at room temperature in a diamond-anvil cell instrument using in-situ high pressure energy dispersive x-ray diffraction with a synchrotron radiation source. The equation of state is determined by fitting the experimental data according to the Birch-Murnaghan equation. It is found that the structure of Ni77P23 amorphous alloy is stable under pressures up to 30.5 GPa. Within the pressure range from zero to the experimental one, the pressure-induced structural relaxation is reversible.     

High-Pressure Phase Transitions of Cubic Y_2O_3 under High Pressures by In-situ Synchrotron X-Ray Diffraction

High-pressure phase transitions of cubic Y_2O_3 are investigated using in situ synchrotron x-ray diffraction in a diamond anvil cell up to 36.3 GPa. The pressure-induced phase transitions of cubic Y_2O_3, which display apparent inconsistencies in previous studies, are verified to be from a cubic phase to a monoclinic phase and further to a hexagonal phase at 11.7 and 21.6 GPa, respectively. The hexagonal Y_2O_3 displays noticeable anisotropic compressibility due to its layered structure and it is stable up to the highest pressure in the present study. A third-order Birch–Murnaghan fit based on the observed pressure-volume data yields zero pressure bulk moduli of180(3), 196(7) and 177(7) GPa for cubic, monoclinic and hexagonal phases, respectively.     

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.     

同步辐射高压衍射技术

同步辐射光源具有宽光谱、高亮度、高准直等优异性能,被广泛地用于高压科学研究。在依托同步辐射光源所发展的诸多高压研究手段中,X射线衍射是最基本的也是应用最多的实验技术之一。本文简单介绍了同步辐射光的独特性能和光源的基本构成,以及同步辐射光束线和实验站的基本概念。针对基于金刚石对顶砧(DAC)的高压X射线衍射技术,阐述了多种测试方法的原理和应用,包括粉末衍射、单晶衍射、多晶衍射、径向衍射、激光加温衍射以及快速加载衍射等。对北京同步辐射装置(BSRF)4W2高压衍射线站所提供的同步辐射光品质、X射线微聚焦能力、多种衍射方法以及新近发展的实验技术进行了较详细的描述,并展望了高能同步辐射光源(HEPS)的建设给高压科学研究带来的机遇。     

Photocatalysts of Cr Doped TiO2 Film Prepared by Micro Arc Oxidation

通过微弧氧化法在Na3PO4+K2Cr2O7电解液中制备了系列铬掺杂二氧化钛薄膜. X射线和扫描电镜显示薄膜的主要晶相为锐钛矿型二氧化钛,且表面为多孔结构. 在可见光照射下,薄膜对降解亚甲基蓝和分解水有着较好的光催化性能,这主要是由铬的掺杂引起的.由于铬的掺杂,一方面在二氧化钛中形成了Cr3+/Cr4+离子对,另一方面在带隙中形成了氧的空位能级. 前者降低了电子-空穴的复合几率,而后者在二氧化钛的禁带中形成了新的能级. 新能级的形成使得由二氧化钛价带跃迁至氧空位能级所需的光子能量减少. 另外探讨了微弧氧化形成掺杂二氧化钛薄膜的机制.     

Phase Transition and EOS of Marmatite （Zn0.76Fe0.23S） up to 623K and 17 GPa

In situ energy dispersive x-ray diffraction for natural marmatite （Zn0.76Fe0.23S） is performed up to 17. 7 GPa and 623 K. It is fit, ted by the Birch-Murnaghan equation of state （EOS） that Ko and α0 for marmatite are 85（3）GPa and 0.79（16）＊10^-4 K^-1, respectively. Fe^2＋ isomorphic replacing to Zn^2＋ in natural crystal is responsible for high bulk modulus and thermal expansivity of marmatite. Temperature derivative of bulk modulus （OK/OT）p for marmatite is fitted to be -0.044（23） GPaK^-1. The unambiguous B3-B1 phase boundaries for marmatite are determined to be Pupper（GPa）= 15.50 - 0.016T（℃） and Plower （GPa）=9.94-0.012T（℃） at 300-623K.     

High-Pressure Phase Transition in Cyclo-octane

Structural behaviour of cyclo-octane under high pressure is studied by using a synchrotron x-ray source in a diamond anvil cell （DAC） up to 40.2 GPa at room temperature. The cyclo-octane firstly solidifies to the triclinic phase at 0.87 GPa. With the increasing pressure, the phase of cyclo-octane changes to the tetragonal phase at about 6.0 GPa and then transforms to amorphous phase above 18.2 GPa, which is kept till to 40.2 GPa. All the phase transitions of cyclo-octane are irreversible.     

Equation of State and Elastic Constants of Compressed fcc Cu

First-principles calculations of equation of state and single-crystal elastic constants of copper are carried out up to twofold compression. The Helmholtz free energies are calculated using the quasi-harmonic phonon approach based on density-functional theory within both the local density approximation and the generalized gradient approximation （GGA）. We find that the results calculated within GGA agree better with the experimental measurements in overall. The equation of state and the zero-pressure single-crystal elastic constants are close to the experimental values.