Bi-Pb-Sr-Ca-Cu-O系反应过程研究

采用高温X射线和DTA技术研究了三步反应法合成Bi-Pb-Sr-Ca-Cu-O超导体的反应过程。实验结果表明样品在740℃能形成2212相,在825℃形成2223相.2212相在875℃左右异分熔化成2201相和液相,2223相在935℃左右同分熔化。2212相在晶化过程中容易形成强的c轴取向。 关键词：     

Existence and thermal stability of mono and dihydride phases on Si(1 1 1) and Ge(1 1 1) surfaces: A photoemission study

Based on UPS and XPS investigations, it is concluded that a monohydride phase forms at first on the Si(1 1 1)7 × 7 surface. Upon further hydrogen dosing at room temperature, a dihydride phase develops and superposes to the previously formed monohydride phase. The dihydride phase desorbs completely around 250°C and the monohydride phase at about 550°C. A pure dihydride phase obtained by H adsorption cannot be observed on a silicon surface. Silane or disilane adsorption at room temperature exhibits the characteristic features of the dihydride phase without the associated monohydride phase. The obtained phase desorbs at the same temperature as the H induced dihydride phase. That is to our mind the only possibility to obtain a pure dihydride phase.

For germanium in careful conditions we observe only a monohydride phase which desorbs at 150°C. For high hydrogen exposures, we obtain a new phase but XPS measurements indicate oxygen contamination. This place desorbs at 225°C and allows clear distinction between H adsorption and contamination. It is concluded that Ge and Si surfaces have different reactivities for hydrogen adsorption. These conclusions are extended to all Ge and Si surfaces either crystallized or amorphous.     

CdTe的状态方程及其高压相变

 用金刚石压砧高压X光衍射技术研究了Ⅱ-Ⅵ族化合物CdTe的室温状态方程和室温高压相变。实验的最高压力达39.2 GPa。实验中发现CdTe从(3.3±0.1)GPa开始从闪锌矿结构相相NaCl结构相转变，相变时体积收缩15.8%；从(10.3±0.2)GPa开始从NaCl相向β-Sn结构相转变，相变时无体积突变；在(12.2±0.2)GPa由β-Sn相向正交结构相转变，相变时也无体积突变。CdTe的压缩数据用最小二乘法以Bridgman状态方程和Murnaghan状态方程拟合，得到其零压时合相变压力时各个相的体弹模量及体弹模量的压力微商，并与其它的实验合理论结果进行比较。     

BeO高压相变和声子谱的第一性原理计算

采用第一性原理方法计算了BeO在零温时的高压相变和三种结构在零温零压时的声子谱.相变的计算表明,在122GPa左右的压力下BeO会发生从纤锌矿(B4)结构到氯化钠(B1)结构的相变,而闪锌矿(B3)结构在零温零压下是一种可能的亚稳态结构.采用冷声子方法计算了这三种结构的BeO在零温零压下的声子谱.计算结果表明:B1结构在零温零压下是一种不稳定的结构;尽管B4结构和B3结构具有明显的相似性,仍然可以通过声子谱来很好的区分.最后根据准简谐近似理论计算得到了BeO的高温高压相图.     

高压下α-石英和柯石英的相变行为

利用金刚石压腔和同步辐射X射线衍射技术,对α-石英和柯石英在常温高压下的相变行为进行了研究。实验结果表明:α-石英在约23 GPa开始发生结构相变,在约44 GPa相变完成,直至59 GPa仍能观察到结晶态;柯石英在约22 GPa转变为柯石英-Ⅱ相,高于36 GPa时,继续发生结构转变,直至59 GPa仍有结晶态;氖气和氩气所提供的不同静水压条件对α-石英和柯石英的高压相变行为影响不大。实验结果为进一步厘清二氧化硅物相的压致相变行为和相变机制提供了实验支撑。     

Temperature dependence of bismuth structures under high pressure

It is unclear whether there is a liquid-liquid phase transition or not in the bismuth melt at high temperature and high pressure. If so, it will be necessary to confirm the boundary of the liquid-liquid phase transition and clarify whether it is a first-order phase transition. Here, based on x-ray absorption spectra and simulations, the temperature dependence of bismuth structures is investigated under different pressures. According to the similarity of characteristic peaks of x-ray absorption near edge structure (XANES) spectra, we estimate the possible temperature ranges of liquid-liquid phase transition to be 779-799 K at 2.74 GPa and 859-879 K at 2.78 GPa, 809-819 K at 3.38 GPa and 829-839 K at 3.39 GPa and 729-739 K at 4.78 GPa. Using ab initio molecular dynamics (AIMD) simulations, we obtain the stable structures of the bismuth melt at different temperatures and pressures, and calculated their electronic structures. Meanwhile, two stable phases (phase III-like and phase IV-like) of bismuth melts are obtained from different initial phases of bismuth solids (phase III and phase IV) under the same condition (3.20 GPa and 800 K). Assuming that the bismuth melt undergoes a phase transition from IV-like to III-like between 809 K and 819 K at 3.38 GPa, the calculated electronic structures are consistent with the XANES spectra, which provides a possible explanation for the first-order liquid-liquid phase transition.     

磁力显微镜对相分离锰氧化物薄膜中反铁磁绝缘相融化的成像

用自制磁力显微镜研究了一个受各向异性应变的锰氧化物薄膜中的相分离以及由磁场导致的从反铁磁绝缘相到铁磁金属相的转变．磁力显微镜图片显示,在0 T这两种竞争的相就已经共存,且两种相 的畴呈非常明显的各向异性的条状分布,这可以定性解释输运上的各向异性．在2.1 T 以上,反铁磁绝缘相逐渐转变为铁磁金属相,并在3.2 T时结束．当去掉磁场时铁磁金属相能够保持．     

On the phase diagram of a two-dimensional electron–hole system

The phase diagram for a system of spatially separated electrons and holes in coupled quantum wells or graphene double layers is studied in the framework of a BCS-like mean-field approach and a Landau expansion in terms of the pairing order parameter. We find a second order transition between an electron–hole plasma and a BCS phase, as well as a first-order transition between the BCS phase and a bosonic Mott phase of tightly bound electron–hole pairs without phase coherence. The electron–hole plasma exists at low and at high densities for weak interaction, the BCS phase at moderate density and the Mott phase at high density and strong interaction.     

LiIO3多型性相变的进一步研究

本文用差热分析、恒温热处理、X射线衍射等方法,对LiIO₃在常压的相变过程做了进一步的研究。对于LiIO₃的常压相变机制有了较为详尽的了解。并发现LiIO₃在高温可相对稳定存在三个相:β,η和δ,它们可分别自行熔化,其熔点相应为:432℃,421℃和416℃,从它们的热经历和存在的温度范围,表明其稳定性顺序为β>η>δ。在室温干燥空气中,与α相和β相共存的还有ζ相,ζ相升温放热转变为β相。在α相存在的温区里,ζ相经过长时间热处理并不转变为α相,同时,ζ相转变为β相的温度比α相高。与α→β的情况相同,β对ζ→β也有诱导作用。而且的ζ存在对α→β也有促进作用。θ相(θ₁与θ₂)与γ相一样,是相变过程的中间过渡相。 关键词：     

High-pressure structural properties of tetramethylsilane

High-pressure structural properties of tetramethylsilane are investigated by synchrotron powder x-ray diffraction at pressures up to 31.1 GPa and room temperature. A phase with the space group of Pnma is found to appear at 4.2 GPa. Upon compression, the compound transforms to two following phases: the phase with space groups of P2_1/c at 9.9 GPa and the phase with P2/m at 18.2 GPa successively via a transitional phase. The unique structural character of P2_1/c supports the phase stability of tetramethylsilane without possible decomposition upon heavy compression. The appearance of the P2/m phase suggests the possible realization of metallization for this material at higher pressure.     

两种扩展Harper模型的波包动力学

本文通过二次矩M₂(t)和概率分布W_n(t)数值地研究了两种扩展Harper模型的波包动力学,得到了这两种模型中各个相、各条临界线以及三相点的波包扩散情况.对于第一种扩展Harper模型,发现两个金属相中波包是弹道扩散的,在绝缘体相中波包不扩散,而在三相点以及各条临界线上波包是反常扩散的.同时,发现金属相—金属相转变的临界线上的波包动力学行为与金属相—绝缘体相转变的临界线上的相同,但三相点的动力学行为与各临 关键词： 金属绝缘体转变 扩展Harper模型 波包动力学     

金红石高温高压相变的Raman光谱特征

以Ar作压力介质,在准静水压力条件下,利用激光加热DAC技术和显微Raman光谱原位测试技术,在0～35 GPa压力范围开展金红石的高温高压相变研究。在室温条件下,金红石结构TiO₂于13.4 GPa开始转变成斜锆石相,于21 GPa时转变完全,并直到35 GPa时斜锆石相稳定存在。在压力分别为29.4和35.0 GPa时,用YAG激光器发出的波长为1.064 μm的红外激光束扫描加热样品,TiO₂斜锆石高压相转变成另一Pbca结构高压相。卸压时,Pbca相于26.3 GPa时转变成斜锆石相。斜锆石相转变成Pbca相需要加热才能发生,而卸压时却在较小的压力区间即迅速转变完全,两相转变压力边界在28 GPa左右。进一步卸压,斜锆石相直到11 GPa仍稳定,在7.6 GPa时斜锆石相与α-PbO2相两相共存,5 GPa时完全转变成α-PbO₂相,并直到常压该相以亚稳定态存在。     

A molecular dynamics simulation of tje uniaxial phase of N2 adsorbed on graphite

A computer simulation study of a nitrogen monolayer adsorbed on a graphite substrate at low temperatures is reported. The adsorbed phase was slightly compressed relative to the commensurate √3 × √3 phase. The compression was taken to be uniaxial; i.e. a 5% change in the large intermolecular spacing along a glide line of the oriented herringbone structure (UXI phase). Thermodynamic properties were evaluated together with orientational and translational ordering parameters at two temperatures, one above (≈ 40 K) and one below (≈ 15 K) the in-plane disordering transition. For purposes of comparison, simulations of the commensurate phase at these temperatures are reported, together with a 15 K simulation of a phase that has been uniaxially compressed in the direction perpendicular to that of the UXI phase (UYI phase). The simulations indicate that the UXI phase is stable but the UYI phase tends to transform into domains of UXI; it is also concluded that the compression necessary to form the UXI phase from the commensurate does not produce a significant change in the out-of-plane ordering, at least at the lower temperature, but does bring about changes in the in-plane ordering of these molecules.     

High-pressure Raman study of solid hydrogen up to 300 GPa

The high-pressure behavior of solid hydrogen has been investigated by in situ Raman spectroscopy upon compression to 300 GPa at ambient temperature. The hydrogen vibron frequency begins to decrease after it initially increases with pressure up to 38 GPa. This softening behavior suggests the weakening of the intramolecular bond and the increased intermolecular interactions. Above 237 GPa, the vibron frequency softens very rapidly with pressure at a much higher rate than that of phase III, corresponding to transformation from phase III into phase IV. The phase transition sequence has been confirmed from phase I to phase III and then to phase IV at 208 and 237 GPa, respectively. Previous theoretical calculations lead to the proposal of an energetically favorable monoclinic C2/c structure for phase III and orthorhombic Pbcn structure for phase IV. Up to 304 GPa, solid hydrogen is not yet an alkali metal since the sample is still transparent.     

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.     

Vibrational spectroscopy at high pressures. Part 50. A Raman scattering study of MSCN (M = K,Rb, Cs,NH4) at high pressures

The phase behaviour of the title compounds was studied at high pressures using Raman spectroscopy. The isostructural materials KSCN and RbSCN show two phase changes (12.5 and 45.5 kbar; 10.5 and 37.5 kbar, respectively) which appear to be second order in type. Structures and transition mechanisms are proposed for each phase. CsSCN has a different orthorhombic structure and shows only one phase change in the range studied, at 23.5 ± 1.5 kbar, which also seems to be second order. The known phase transition in NH₄SCN at 2 kbar has been confirmed, and a new one found at 10 kbar. A monoclinic cell is proposed for the new phase.     

Competing orders in FeAs layers

Using the unrestricted Hartree-Fock approximation and Landau theory we identify possible phases competing with superconductivity in FeAs layers. We find that close to half-filling the transition from the paramagnet to the magnetically ordered phase is first order, making anharmonicities relevant and leading to a rich phase diagram. Between the already known one-dimensionally modulated magnetic stripe phase and the paramagnet we find a new phase which has the same structure factor as the former but in which magnetic moments at nearest-neighbor sites are at right angles making electrons acquire a nontrivial phase when circulating a plaquette at strong coupling. Another competing phase has magnetic and charge order and may be stabilized by charged impurities.     

压缩真空光输入和光子计数法增强Sagnac效应

压缩真空光输入和平衡零拍探测可有效增强Sagnac效应,提高陀螺精度;考虑平衡零拍探测的相位精度与相位自身相关,仅在某特定相位能达到最佳灵敏度,设计了一种基于光子计数法提取Sagnac输出相位的方案,并利用贝叶斯理论估计相位.理论分析结果表明,该方法能突破散粒噪声极限,相位精度不再受限于相位自身,且当压缩真空光和相干激光功率相同时,精度在理论上能达到海森堡极限.     

Pressure-induced phase transition in β-eucryptite (LiAlSiO4)

A pressure-induced phase transition was found in β-eucryptite using single crystal X-ray and Raman scattering measurements. The high pressure phase forms at a pressure of ～8 kbar at 300 K, is metastable at 1 bar and will revert to the normal low pressure phase with time at this temperature.     

High-energy x-ray diffraction study on phase transition asymmetry of plastic crystal neopentylglycol

As a prototype material of colossal barocaloric effects, neopentylglycol is investigated by combining high-precision differential scanning calorimetric measurement and high-energy x-ray diffraction measurement. The diffraction data at constant temperatures indicate a first-order phase transition with thermal hysteresis as well as the phase transition asymmetry, specifically, the phase transition is completed faster at cooling than at heating. The analysis of resulting pair distribution function confirms the intermolecular disorder in the high-temperature phase. The phase transition asymmetry is quantitatively characterized by time-resolved x-ray diffraction, which is in agreement with the thermal measurement. Also, such an asymmetry is observed to be suppressed at high pressures.