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First-principles plane-wave pseudopotential calculations were performed to study energetics , the geometry structures of intrinsic vacancies and interstitials on the anatase TiO2 (101) crystal surface.

采用平面波超软赝势方法计算了锐钛矿型TiO2(101)面存在本征空位和间隙点缺陷的几何结构以及缺陷形成能。

Then a high-degree geometric continuity blending surface is obtained with transfinite interpolate method.

将其充分性与超限插值方法相结合,成功地构造出两个参数曲面间的高阶几何连续过渡曲面。

Surface roughness and geometry topography have very obvious difference between ordinary and ultraprecision grindings. Surface roughness of ultrapreciscon grinding will decrease with abrasive size and grinding depth decrease, surface veining owing to plastic deformation is very clear.

超精密磨削和普通磨削的表面粗糙度和几何形貌存在明显的差异,超精密磨削的表面粗糙度随着金刚石砂轮磨粒尺寸和磨削深度的减小而减小,表面由于塑性变形形成的纹理比较明显。

A model of linear strain relaxation is proposed to obtain the interatomic longitudinal spacings of the strained superlattice.

在线性驰豫应变假设下给出了应变超晶格纵向原子间距的几何模型。

For m-modal maps with m turning points C1,C2,…,Cm, by defining equivalent scalingfactors α_e as the geometric average of all scaling factors α_Ci (i=1,2,…,m),|α_e|=|α_C1α_C2…α_Cm|1/m, global superuniversal relationship between equivalent scaling factors α_e and fractal dimensions d of Feigenbaum-type attractors on all the infinitely many critical points of transitions to chaos is obtained: dlog_|α_e|=β~, where|W| is the basic period of the m-tuply superstablesequences W, and β~ is not only independent of the concrete sequences W, but also independent of the concrete maps.

对于具有m个转变点C_1,C_2,…,C_m的m峰映射,通过定义等效标度因子α_e为所有标度因子α_(i=1,2,…,m)的几何平均,|α_e|=|α_(C_1)α_(C_2)…α_|~(1/m),得到了等效标度因子α_e与所有无穷多个转变至混沌的临界点上Feigenbaum型吸引子的分维d之间的一个整体性的超普适关系:dlog_|α_e|=β~(e,其中|W|是m超稳序列W的基本周期,超普适常数β~(e不仅不依赖于具体的序列W,而且也不依赖于具体的映射。

A numerical simulation was conducted for a fixed-geometry two-dimensional mixed-compression supersonic inlet with sweepforward high-light and "X" type missile configuration. The results indicate:(1) The total pressure recovery declines with the rise of the free stream Mach number, while the mass flow ratio rises firstly and then declines when its maximum value is obtained at the design point.

针对一种定几何二元倒置&X&型混压式超声速进气道开展了数值仿真研究,结果表明:随着来流马赫数的增加,进气道总压恢复系数下降,而流量系数却先上升,在设计点达到最大值后下降。

The equilibrium geometries of squaraines substituted by heteropentacyclic, benzo fuzed heteropentacyclic, heterohexacyclic, benzo fuzed heterohexacyclic, heptacyclic, benzo fuzed heteroheptacyclic and zwitterionic squaraines were obtained with ab initio calculation at HF/6-31G* level and the electronic spectra were examined using CIS/6-31G* method.

用从头算6-31G~*方法优化了多种五元杂环、苯并五元杂环、六元杂环、苯并六元杂环、七元环和苯并七元杂环取代的方酸分子以及方酸两性离子分子的几何结构;用CIS/6-31G~*方法计算了其电子光谱;通过TDHF/6-31G~*方法计算其线性极化率、一阶和二阶超极化率来研究分子结构和非线性光学性质之间的关系,同时用两态模型解释了部分分子的一阶超极化率。

Therefore, for improving the accuracy of exceed slender axle on turning,must need to do with the lathe fixture and cutting tool for further improvement. In order to reached the requirements of precision machining,in machining process must use follower rest、flexible active thimble、space block and bracket etc fixture and assistive device.

超细长轴在车削加工中承受自身重力、切削力、高速旋转产生的离心力的作用,极容易出现振动与弯曲变形现象,增大轴的几何形状误差,而超细长轴的轴向尺寸较大,直径较小,热扩散性及刚性差,受切削热作用会在轴向发生线性膨胀,若在轴向的伸长量无法得到消除,轴将受迫弯曲,从而影响轴的精度。

It also introduces the discrete ordinates couple-solving method (DOT-BSTP-DOT) which uses the half-symmetric angular quadratures for core geometry and the quadratic S〓 biasing angular quadratures for duct geometry. Calibrations for several types of duct are carried out and the schemes of XPR epithermal neutron filter are successfully designed. The other international popular code ANISN is also exploited and modified.

本论文首先开发、修改了其它国际通用屏蔽计算程序DOT/4.2和MCNP/4B,编制了边界源转换程序BSTP,首次建立深穿透屏蔽计算的临界源方向偏倚与指数变换相结合的蒙特卡罗耦合抽样方法,以及堆芯几何采用半对称求积基、孔道几何采用二阶S〓偏向求积基的离散坐标耦合求解法(DOT-BSTP-DOT),并对不同孔道进行了数值校算,成功地得到了西安脉冲堆超热中子过滤器的设计方案。

In this article, optical and electronic properties of ZnO doped by Al are studied based on DPT theory. Correlation energy of electron exchange is combined with GGA in the form of PW91. The elements doped by replacement and inside of ZnO are calculated. The lattice and electronic structure properties of these models are calculated and compared with the experiments and previous theoretical works.

采用基于密度泛函理论的总体能量平面波超软赝势法,电子交换关联能结合广义梯度近似PW9l形式,对Al原子不同掺杂位置的ZnO超原胞进行了几何优化,计算分析了晶体结构参数及掺杂模型的电子结构。

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We have no common name for a mime of Sophron or Xenarchus and a Socratic Conversation; and we should still be without one even if the imitation in the two instances were in trimeters or elegiacs or some other kind of verse--though it is the way with people to tack on 'poet' to the name of a metre, and talk of elegiac-poets and epic-poets, thinking that they call them poets not by reason of the imitative nature of their work, but indiscriminately by reason of the metre they write in.

索夫农 、森那库斯和苏格拉底式的对话采用的模仿没有一个公共的名称;三音步诗、挽歌体或其他类型的诗的模仿也没有——人们把&诗人&这一名词和格律名称结合到一起,称之为挽歌体诗人或者史诗诗人,他们被称为诗人,似乎只是因为遵守格律写作,而非他们作品的模仿本质。

The relationship between communicative competence and grammar teaching should be that of the ends and the means.

交际能力和语法的关系应该是目标与途径的关系。

This is not paper type of business,it's people business,with such huge money involved.

这不是纸上谈兵式的交易,这是人与人的业务,而且涉及金额巨大。