Mo2C膜表面快速粗糙化现象研究

介绍了Mo2 C膜表面粗糙度的测量结果 ,引入晶粒边界修正 ,对Mo2 C膜的表面快速粗糙化现象给予理论解释 .     

InGaAs薄膜表面的粗糙化过程

采用STM分析InGaAs表面形貌演变研究InGaAs表面的粗糙化和预粗糙化等相变过程, 特别针对In_0.15Ga_0.85As薄膜表面预粗糙化过程进行了深入研究. 发现In_0.15Ga_0.85As薄膜在不同的衬底温度和As等效束流压强下表现出不同的预粗糙化过程. 在低温低As等效束流压强下, 薄膜表面将经历从有序平坦到预粗糙并演变成粗糙的过程, 起初坑的形成是表面形貌演变的主要形式, 随着退火时间的延长, 大量坑和岛的共同形成促使表面进入粗糙状态; 在高温高As等效束流压强下薄膜表面将率先形成小岛, 退火时间延长后小岛逐渐增加并最终达到平衡态, 表面形貌将长期处于预粗糙状态.     

Mo2C二维材料晶格热导率的第一性原理研究

Mo₂C是构建Mxene基器件的重要材料之一,对Mo₂C二维材料声子输运的理解非常必要.文章结合第一性原理方法和声子玻尔兹曼输运方程,研究了二维Mo₂C材料的晶格热导率.研究表明,室温下二维Mo₂C导热系数非常低,其锯齿方向和扶手椅方向的晶格热导率分别为7.20和5.04 W/mK.计算了声学振动和光学振动模式对晶格热导率的贡献,揭示总热导率主要由面内声学横波的振动模式所贡献.还进一步计算了声子群速度、声子弛豫时间、三声子散射空间和模式格林艾森参数,发现二维Mo₂C中的声子群速度和声子弛豫时间对晶格传输有重要的影响.     

Mo1-xWxC碳化物稳定性及力学性质的第一性原理计算

金属碳化物作为基体的增强相,对钢铁的力学性能起到至关重要的作用.采用基于密度泛函理论的第一性原理方法,通过虚拟晶体近似构建Mo_1-xW_xC(0≤X≤1)碳化物模型,计算Mo_1-xW_xC的晶格常数、形成能、结合能、弹性常数、弹性模量、泊松比u、维氏硬度、电子态密度等性质参数,分析W元素对MoC碳化物稳定性及力学性能的影响.本次计算值与其他理论计算值及试验值吻合度较高;随着W含量的增加,晶格常数增加,Mo_1-xW_xC的形成能、结合能皆为负值,结合能、形成能的绝对值均随着W含量的增加而增加.不同掺杂含量下的Mo_1-xW_xC均满足Born判据,在力学上是稳定的,随着W含量的增加,Mo_1-xW_xC的弹性常数、体模量、杨氏模量、剪切模量呈线性增加,B/G、泊松比降低. Mo_1-xW_xC在费米能级处的态密度值均不为0,态密度值随着W含量的增...     

水热法制备Mo1-XWXS2合金材料及晶体结构的研究

采用水热合成法制备合金半导体材料Mo_1-XW_XS₂（X为浓度）,并应用扫描式电子显微镜（SEM）、X射线衍射（XRD）和拉曼光谱仪（Raman）对其形貌和晶体结构进行表征。实验结果表明,由SEM形貌测试发现,随着掺杂浓度的增加,Mo_1-XW_XS₂片状合金材料表面逐渐粗糙;由XRD晶体结构表征发现,随着掺杂浓度的增加,Mo_1-X W_XS₂的晶格常数逐渐增大;在合金材料的拉曼频移中,随着掺杂浓度的增加,Mo_1-XW_XS₂中A_1g振动模发生蓝移,而E¹_2g振动模发生红移。通过晶格结构和拉曼频移的检测和分析,证实水热合成法可制备不同浓度的Mo_1-XW_XS₂合金半导体材料。本方法可进一步拓展为二硫族化物合金...     

倾斜粗糙壁面上含不溶性活性剂溶液的动力学特性

针对倾斜随机粗糙壁面上含不溶性活性剂溶液的流动过程, 采用润滑理论建立了液膜厚度和浓度的时空演化模型, 通过PDECOL程序数值求解得到了液膜流/液滴铺展的动力学特性及壁面结构参数的影响. 研究表明: 在重力分量和Marangoni效应共同作用下, 液膜流/液滴铺展速度加快, 液膜边缘和液滴中心出现毛细隆起, 液膜/液滴底部出现凹陷, 同时受粗糙壁面影响, 液膜表面变形更显著. 增加壁面倾角θ具有使重力分量和Marangoni效应增强, 导致隆起和凹陷程度均有所增加的作用. 增大壁面高度D可使液膜流/液滴铺展速度加快, 表面变形放大. 而壁面波数k₀则使液膜流/液滴铺展过程减缓, 抑制隆起和凹陷产生. 与液膜流相比, D和k₀对液滴铺展速度的影响相对较小. 关键词： 随机粗糙壁面 液膜 Marangoni效应 倾斜流动     

MoxGe1-x,MoxSi1-x薄膜的非晶形成成份及超导转变温度

用直流吸气溅射法在液氮冷底板上分别制备了Mo_xGe_1-x,Mo_xSi_1-x的薄膜。其形成非晶的成份分别为Ge>22at%,Si>18at％。超导转变临界温度T_c在非晶状态下随着Ge,Si的含量增加而下降(约6—3K)。非晶Mo₇₇Ge₂₃膜的晶化温度为780℃,而非晶Mo₇₈Si₂₂膜的晶化温度为480℃。 关键词：     

静高压下有表面化学反应的非晶合金晶化研究

在静高压3—5GPa,510—660℃温度下,研究了在晶化过程中其表面与Al发生反应的非晶(Fe_0.99,Mo_0.01)₇₈Si₉B₁₃合金的晶化过程。发现在4GPa左右,510—660℃的温度范围内,非晶FMSB晶化为纳米α-Fe(Al)相,在其他压力下,晶化为α-Fe(Mo,Si),(Fe,Mo)₃B或Fe₂B相。利用简单固体模型对其晶化的热力学机制 关键词：     

具有分形结构的SiC/SiO2界面的粗糙散射

用结构函数的方法建立了SiC粗糙表面的分形模型,用rms粗糙度Δ,分形维数D,以及相关长度L三个参量来刻画表面高度的自协方差函数,并提出了参数的计算方法.在此分形模型的基础上,能计算出SiC/SiO₂界面对沟道电子的粗糙散射.     

单原子Al修饰空位缺陷V2C（MXene）对H2气体表面吸附的第一性原理研究

基于第一性原理计算方法,对含空位缺陷的V₂C(MXene)在不同位点修饰单原子Al的相关性能进行系统研究.研究表明,几何优化后得到含空位缺陷的V₂C稳定结构表面能为-3075.53 J/m²,单原子Al修饰本征V₂C单原子的吸附能为1.5511eV、单原子Al修饰空位缺陷V₂C的吸附能为-2.0763 eV,这表明含空位缺陷的V₂C,由于单原子Al的修饰可以明显改善晶体结构稳定性.进一步从态密度、分波态密度、吸氢能力研究发现,各体系态密度和分波态密度均出现分波越过费米能级的现象,表现出较强的金属性;V₂C吸附H₂气体分子吸附能为-7.5867 eV,而空位缺陷V₂C和单原子Al修饰空位缺陷V₂C两个体系对H₂气体分子的吸附能仅为-0.9851 eV、-2.7130 eV,均未能进一步改善V₂C对H₂气体分...     

Thermally stimulated luminescence from alkaline earth borates

The thermally stimulated luminescence from XB₂O₄ (X=Ca,Sr,Ba) has been investigated. The results on CaB₂O₄ and SrB₂O₄ are being reported here for the first time. In both cases, the emission is found to be quite intense, contrary to the case with BaB₂O₄. The presence of two peaks in the glow curves is noted over the temperature range of 300-570 K. The emission spectra corresponding to both the peaks have been observed to be identical, consisting of two broad emissions, one in the UV and other in the blue-green regions. The emission is apparently quite different from that of BaB₂O₄ in which case only very weak emission spreading over a broad wavelength range around 410 nm is observed. This result has been understood in terms of the overlap between the excitation and the emission spectra.     

Preparation and magnetic properties of BaFe12O19/Ni0.8Zn0.2Fe2O4 nanocomposite ferrite

Nanocomposite of hard (BaFe₁₂O₁₉)/soft ferrite (Ni_0.8Zn_0.2Fe₂O₄) have been prepared by the sol–gel process. The nanocomposite ferrite are formed when the calcining temperature is above 800 °C. It is found that the magnetic properties strongly depend on the presintering treatment and calcining temperature. The “bee waist” type hysteresis loops for samples disappear when the presintering temperature is 400 °C and the calcination temperature reaches 1100 °C owing to the exchange-coupling interaction. The remanence of BaFe₁₂O₁₉/Ni_0.8Zn_0.2Fe₂O₄ nanocomposite ferrite with the mass ratio of 5:1 is higher than a single phase ferrite. The specific saturation magnetization, remanence magnetization and coercivity are 63 emu/g, 36 emu/g and 2750 G, respectively. The exchange-coupling interaction in the BaFe₁₂O₁₉/Ni_0.8Zn_0.2Fe₂O₄ nanocomposite ferrite is discussed.     

Magneto-transport properties of La0.7Ca0.3MnO3/SrTiO3/La0.7Ce0.3MnO3 tunnel junction

Hole-doped rare-earth manganite La_0.7Ca_0.3MnO₃ and the electron-doped manganite La_0.7Ce_0.3MnO₃ both show a metal-insulator transition around 250 K associated with a ferromagnetic transition and colossal magnetoresistance. In an earlier publication we have reported the rectifying characteristic of La_0.7Ca_0.3MnO₃/SrTiO₃/La_0.7Ce_0.3MnO₃ tunnel junction at room temperature, showing that it is possible to fabricate a diode out of the polaronic insulator regime of doped manganites. Here we report the magneto-transport properties of such a tunnel junction above and below the metal-insulator transition. We show, from the large positive magnetoresistance of the tunnel junction at low temperature, that La_0.7Ce_0.3MnO₃ could be a minority spin carrier ferromagnet. The implication of this observation is discussed.     

Relation between highT c superconductivity and structure: A study of Ba3+x Cu6O14+δ and YBa2Cu3O7−δ systems

Superconductivity is found in tetragonal La_3−x Ba_3+x Cu₆O_14+δ and La, Ba)_6−x Sr _x Cu₆O_14+δ even though they do not possess Cu-O chains or the K₂NiF₄ structure. Resistivity measurements confirm the occurrence of a transformation from chain-superconductivity to sheet-superconductivity in YBa₂Cu₃O_7−δ as δ is varied in the range 0.0–0.5. Contribution No. 481 from the Solid State and Structural Chemistry Unit     

Mechanism of amorphous Ge2Sb2Te5 removal during chemical mechanical planarization in acidic H2O2 slurry

In this paper, chemical mechanical planarization (CMP) of amorphous Ge2Sb2Te5 (a-GST) in acidic H2O2 slurry is investigated. It was found that the removal rate of a-GST is strongly dependent on H2O2 concentration and gradually increases with the increase in H2O2 concentration, but the static etch rate first increases and then slowly decreases with the increase in H2O2 concentration. To understand the chemical reaction behavior of H2O2 on the a-GST surface, the potentiodynamic polarization curve, surface morphology and cross-section of a-GST immersed in acidic slurry are measured and the results reveal that a-GST exhibits a from active to passive behavior for from low to high concentration of H2O2 . Finally, a possible removal mechanism of a-GST in different concentrations of H2O2 in the acidic slurry is described.     

Double-ceramic-layer thermal barrier coatings based on La2(Zr0.7Ce0.3)2O7/La2Ce2O7 deposited by electron beam-physical vapor deposition

Double-ceramic-layer (DCL) thermal barrier coatings (TBCs) of La₂(Zr_0.7Ce_0.3)₂O₇ (LZ7C3) and La₂Ce₂O₇ (LC) were deposited by electron beam-physical vapor deposition (EB-PVD). The composition, interdiffusion, surface and cross-sectional morphologies, cyclic oxidation behavior of DCL coating were studied. Energy dispersive spectroscopy and X-ray diffraction analyses indicate that both LZ7C3 and LC coatings are effectively fabricated by a single LZ7C3 ingot with properly controlling the deposition energy. The chemical compatibility of LC coating and thermally grown oxide (TGO) layer is unstable. LaAlO₃ is formed due to the chemical reaction between LC and Al₂O₃ which is the main composition of TGO layer. Additionally, the thermal cycling behavior of DCL coating is influenced by the interdiffusion of Zr and Ce between LZ7C3 and LC coatings. The failure of DCL coating is a result of the sintering of LZ7C3 coating surface, the chemical incompatibility of LC coating and TGO layer and the abnormal oxidation of bond coat. Since no single material that has been studied so far satisfies all the requirements for high temperature applications, DCL coating is an important development direction of TBCs.     

The nature of antimony-enriched surface layer of Fe-Sb mixed oxides

Antimony segregation is a common feature in Fe-Sb mixed oxides, which have been widely applied as catalysts in selective oxidation and ammoxidation reactions. This paper attempts to shed a light on the cause of such a common feature and on the nature of the antimony-enriched surface layer over FeSbO₄ by means of XPS surface analysis. Single-phase FeSbO₄ samples prepared by different methods were studied, and the antimony in their surface layer is a mixture of both Sb⁵⁺ and Sb³⁺ rather than single Sb⁵⁺. Their surface composition is close to FeSb₂O₆, which could be described as (FeSbO₄)(Sb₂O₄)_δ, δ = 0.5, and it is not “Fe(II)Sb(V)₂O₆” as suggested in literature. Fe-Sb mixed oxides with Sb/Fe > 1 (mol/mol) are mixtures of FeSbO₄ and Sb₂O₄, and the surface of FeSbO₄ grains would be a layer of (FeSbO₄)(Sb₂O₄)_δ, δ ≥ 0.5. Fe-Sb mixed oxides with Sb/Fe < 1 are mixtures of FeSbO₄ and Fe₂O₃, and the surface of FeSbO₄ grains would be a layer of (FeSbO₄)(Sb₂O₄)_δ, δ ≤ 0.5, but the remaining Fe₂O₃ would be encapsulated by a layer of FeSbO₄.     

飞机跑道胶痕的自动识别系统设计与实现

为了减轻机场跑道除胶工作人员的劳动强度,提高除胶工作效率,文章提出了一种基于机器视觉的胶痕自动查找和识别方法,设计了基于ARM单片机控制的图像无线采集和基于PC机控制的图像接收、图像预处理和图像识别系统。文章通过分析预处理后的数据特点,确定了基于细胞神经网络算法的胶痕识别算法,然后在MATLAB仿真环境下确定了该算法的最优模型和参数,最后在Visual C++ 6.0环境下完成了该算法的程序编译,调试并完成了对胶痕的自动识别过程。理论仿真和程序测试的结果证明了文章提出的方法在胶痕自动识别系统中的可行性,也为机场特种设备的无人化和智能化提供了参考。     

Novel 1122 thallium cuprates showing high Tc superconductivity: TlCa1-xY,Ba2Cu2O y,T,1-xPb x CaSr2Cu2O y and TlCa0.5Ln0.5Sr2Cu2O y

Substitution of Ca by Y in TlCaBa₂Cu₂O _y does not favour superconductivity, but substitution of Tl by Pb or of Ca by Ln (Ln = Y or rare earth) in TlCaSr₂Cu₂O _y results in high T_c superconductivity (T_c π 60–90 K). TlCa_1-xLn _x Sr₂Cu₂O _y is a new series of high T_c superconductors, but the x = 0.0 composition does not exhibit bulk superconductivity.     

High Field ESR System and Its Application to the Study of Quantum Spin Systems

Developments of the high field ESR system in Kobe University is presented. Using Gunn oscillators and backward traveling oscillators (BWO), we can cover the frequency region from 30 to 1183.6 GHz with the use of InSb detector. Pulsed magnetic field up to 30 T is available and we are now trying to extend the field up to 40 T. Temperature range is from 1.8 to 300 K. Using this system, we studied S=1/2 ladder like system Cu₂(C₅H₁₂N₂)₂Cl₄, and found a new magnetic transition at 10.1 T at 1.8 K. The temperature dependence of ESR in Cu₂(C₅H₁₂N₂)₂CI₄ shows g-shift below 8 K which corresponds to the maximum of the magnetic susceptibility. The g-shift below 8 K suggests the increase of the quantum fluctuation in the system, and the role of the quantum fluctuation in Cu₂(C₅H₁₂N₂)₂CI₄ is discussed.