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71.
β-MnO2高压相的从头计算模拟   总被引:1,自引:0,他引:1       下载免费PDF全文
 基于密度泛函理论(DFT),用完全势能线性缀加平面波方法(FPLAPW)计算模拟了MnO2的同质多相变体(金红石型结构、CaCl2型结构、黄铁矿型结构),通过计算,预测了β-MnO2在5 GPa时从金红石型结构转变为CaCl2型结构,在20 GPa时进一步转变为黄铁矿型结构。另外,还总结和比较了几种金红石型结构二氧化物的压致相变特点,得出第Ⅳ主族元素的金红石型结构氧化物有很好的规律性,发生的相变序列基本一致;并随着金属阳离子半径的增大,发生相变的压力值也相应地递减,各氧化物的体积模量值相应地减小。  相似文献   
72.
 提出了一种适用于环板结构的计算等效相对介电常数的方法,利用变分法导出了介质加载环板慢波结构的色散方程和耦合阻抗表达式。计算结果表明,介质加载能够有效降低环板慢波结构的工作电压。计算结果与CST-MWS的模拟结果吻合良好,说明所提出的计算等效相对介电常数的方法和计算色散方程的方法对环板慢波结构是切实可行的。  相似文献   
73.
As borders between different entities, lines are an important element of natural images. Indeed, the neurons of the mammalian visual cortex are tuned to respond best to lines of a given orientation. This preferred orientation varies continuously across most of the cortex, but also has vortex-like singularities known as pinwheels. In attempting to describe such patterns of orientation preference, we are led to consider underlying rotation symmetries: Oriented segments in natural images tend to be collinear; neurons are more likely to be connected if their preferred orientations are aligned to their topographic separation. These are indications of a reduced symmetry requiring joint rotations of both orientation preference and the underlying topography. This is verified by direct statistical tests in both natural images and in cortical maps. Using the statistics of natural scenes we construct filters that are best suited to extracting information from such images, and find qualitative similarities to mammalian vision. PACS84.35+i 89.70.+c 87.57.Nk  相似文献   
74.
Quenching of the eutectoidal composition of the shape memory alloys (SMA’s) allowed us to display the gradual transition of the martensitic structure as a function of the composition. Indeed, we have verified that for low Al and Ni percentages, the martensite structure obtained is β′, while, for high Al and Ni (Al<13.3 mass%) contents, the martensite structure is essentially of β1′ type. Elsewhere, we have observed that a nickel addition (<4.3 mass%) operates simultaneously on the composition of the eutectoidal pointand the domain of the different martensitic structures types. During reheating of the quenched structure, the transformation sequences of the martensite to the parent phase (β1), then the decomposition of the later phase into the equilibrium phases, and finally, the redissolution of all phases to form the β phase at high temperature, are rather similar. This revised version was published online in August 2006 with corrections to the Cover Date.  相似文献   
75.
我国上市公司资本结构决策的实证研究   总被引:4,自引:0,他引:4  
本在已有资本结构理论研究成果的基础上,对30家沪市上市公司的资本结构进行了实证研究,提出了在我国资本市场环境下优化企业资本结构的对策建议。  相似文献   
76.
The dielectric responses (i.e. the refractive indices and the second order nonlinear susceptibilities) of all orthorhombic rare earth molybdates have been studied on the basis of the relationship between dielectric responses and the average atomic number of constituent atoms of crystals. Both the linear and second order nonlinear optical responses at 1.064 μm decrease with increasing atomic number from La to Lu.  相似文献   
77.
Bond covalency and valence of elements in HgBa2Can−1CunO2n+2+δ (n=1, 2, 3, 4) were calculated and their relationship with Tc was discussed. For both oxygen and argon annealed samples, the results indicated that with the increase of n, the trend of bond covalency of Hg-O and Cu-O was the same or opposite compared with that of superconducting temperature. This may suggest that the magnitudes of Cu-O and Hg-O bond covalency are important in governing the superconducting temperature. For the highest Tc sample, Hg had the lowest valence, implying that lower valence of Hg was preferred in order to produce higher Tc. For fixed n, the valence of Cu in oxygen annealed samples was larger than that in argon annealed samples, indicating that oxygen annealed samples produced more carriers than argon annealed samples.  相似文献   
78.
The high-temperature cubic phase of non-stoichiometric strontium ferrite SrFeOx (2.5≤x≤3.0) has been studied by in situ neutron powder diffraction in air over the temperature range 300-1273 K. The composition of SrFeOx changes within the range 2.56≤x≤2.81 from 1273 to 673 K, respectively.Rietveld refinements of the diffraction patterns show that the high-temperature cubic phase of SrFeOx is consistent with a face-centred Fm3c structure. This structure leads to agreement with previous density measurements. This cell allows the high-temperature structure of SrFeOx to be described in terms of a solid solution of the composition end members. Cubic SrFeOx at high temperature is found to closely obey Vegard's law. The density of cubic SrFeOx is also found to exhibit a linear relationship with composition.  相似文献   
79.
据统计,我国每天困饮酒过量而产生的车祸竟达交通事故伤亡总人数的50%-60%,酒后驾车的问题已经引起了社会各界的高度重视.为此本文建立了酒后血液中酒精含量的房室数学模型,从而为司机饮酒驾车提供合理的忠告和建议.  相似文献   
80.
设X是p一致凸Banach空间,具有弱一致正规结构与非严格的Opial性质.又设C是X的非空凸弱紧子集.在适当的条件下,证明了C上每个渐近正则半群T={T(t):t∈S}都有不动点进一步,在类似的条件下,也讨论了一致凸Banach空间中渐近正则半群的不动点的存在性.  相似文献   
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