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The filled skutterudite compound possesses bcc structure as evidenced by electron diffraction analysis. Powder X-ray diffraction data of filled skutterudite samples were characterized by Rietveld method for some crystallographic parameters such as lattice constant, atomic occupation, atomic position, etc.

另外,通过对化合物电子衍射的分析证实了〓化合物是一种具有bcc结构的化合物;运用Rietveld方法对填充skutterudite化合物X衍射谱线进行了分析,对化合物的晶格常数、原子位置的占有率以及原子位置坐标等晶体学参数进行了表征。

A theoretical description of the deformed state of QCs requires a combined consideration of interrelated phonon and phason field. The phonon field describes the motion of lattices in physical space, while the phason field describes the quasiperiodic arrangement of atoms in the complementary orthogonal space, which interact with one another. Owing to the existence of phason field, the elasticity of QCs is more complex than that of the conventional crystals.

准晶弹性的刻画不仅需要描写晶格振动的声子场,还需要刻画原子准周期排列的相位子场,而且二者是相互耦合的,所以准晶的弹性较经典的一般晶体的弹性复杂的多。

Additionally, there was new AES that may be a transition form of hybridism of carbon atom. It is concluded that carbon atom of graphite changes from sp^2 π to sp^3 through "metal catalyst layer", and deposits on the surface of diamond.

结果表明高温高压条件下石墨中碳原子经过"金属催化剂层"才能将碳原子的电子构形从SP^2π态改变成SP^3态,碳原子从而以金刚石四面体结构沉积到金刚石表面,金刚石晶格结构的形成是在金刚石表面层完成的。

According to these results, it is considered that in the matrix of gray cast iron nitrogen solid-solubilizes as interstitial atom in the octahedron interstice of ferrite and cementite which is not occupied by carbon atom, and causes the crystal lattice of ferrite and cementite to distort, so that the micro-hardness of the matrix increases.

依据这一实验结果,作者认为,在灰铸铁基体组织中,氮以间隙原子的方式固溶在铁素体和渗碳体中未被碳原子占据的八面体间隙里,造成铁素体和渗碳体晶格畸变,从而提高了基体组织的显微硬度。

Using the modified analytical embedded atom method, the physical properties of D03 type Fe3Al alloy, including the lattice constant, formation heat, elastic constants, phonon dispersion curves, density of states, molar heat capacity at constant volume, Debye temperature and thermal expansion, were calculated. The calculated results were compared with the experimental data and those obtained by others.

摘 要:应用改进分析型嵌入原子模型,系统地计算了D03 结构Fe3Al合金的晶格动力学性能,包括晶格常数、形成热、弹性常数、声子谱、态密度、摩尔定容热容、德拜温度和热膨胀系数等,并将计算结果与已有实验数据和其他理论计算结果进行了比较。

Based on the atomic interaction potential with the embedded atom, molecular dynamics simulation was used to study the variation of Cu(001) surface caused by a Cu adatom and the hopping barriers of another Cu adatom in its vicinity.

采用嵌入原子方法的原子间相互作用势,利用准静态分子动力学模拟研究了Cu原子在Cu(001)表面吸附所导致的基体晶格畸变以及对其附近的另一个吸附原子自扩散行为的影响。

The element Sb exists in many forms in the film: transpositional atoms and compounds such as Sb2O3, Zn7Sb2O14 etc. ZnO crysal grains grow in mixing directions. The lattice relaxation and content of second phases increase when more Sb is doped. The UVA absorption of doped ZnO thin film obviously increases. The ultraviolet absorption peak narrows, the absorption intensity increases, the absorption margin becomes steep and moves to shorter wavelength about 5 nm, and the visible absorption increases in some sort.

薄膜中Sb以多种形态存在:替位原子和化合物(Sb2O3、Zn7Sb2O14)等,ZnO呈混晶方式生长;随着Sb含量的增加,其引起的晶格畸变和次晶相的含量逐渐增加;掺杂薄膜在远紫外波段的吸收显著增强,UV吸收峰变窄,强度增大,吸收边变得陡峭且向短波方向移动达5nm,在Vis波段的吸收有所增强。

A layer of tin atoms on a germanium surface forms a flat lattice, but at temperatures below about 150 Kelvin--for reasons that aren't entirely clear--the tin layer spontaneously corrugates to form a new structure, or phase, with one atom out of every three moving away from the substrate.

一层锡原子在锗表面可以形成一个平整的晶格,但是当温度低于150K锡原子层会自发的褶皱起来形成一种新的结构,或者说是新相,这时每三个原子中会有一个运动而离开基质表面。

What makes minerals special is the way that the atoms of those elements are arranged in lattices which create unique crystalline structures and shapes.

矿物质的特别之处在于这些元素中的原子形成的晶格,而晶格创造了独特的晶状结构和形状。

What makes minerals special is the way that the atoms of those elements are arranged in lattices which create unique crystalline structures and shapes.

使矿物特别的是那些元素原子按晶格排列的方式,晶格创造了独特的晶状结构和形状。

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