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The calculated results indicate that Chens lattice inversion method was exact for radial interatomic potential of alkali metals with much faster convergence than CGE method.

计算表明,陈氏三维晶格反演比CGE方法具有更快的收敛性,容易获得较高精度的原子间相互作用势。

However, epitaxy of PZT films directly on Si substrates is very difficult because of the lattice mismatch between them and the interdiffusion owing to the high growth temperature during deposition.

摘要 将PZT 薄膜沉积於Si 基板上是非常困难的,主要由於两者晶格常数的不匹配以及在高温沉积时相互间的扩散问题。

The 4-sublattice model of R-Fe-Mn intermetallic compounds has been proposed, and all the experimental results can be explained by means of this model.

提出了R-Fe-Mn金属间化合物的4次晶格模型,本研究中的试验现象可以用该模型来解释。

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。

We present an analysis of the defect by inverse Fourier transformation.

结果发现,当且仅当反映面心有序的超结构反射被用来作反Fourier变换时,晶格条纹在反相畴界处错开。

The chemical bonding is formed the between coating and the substrate. The bond shows a mixed property of covalent bond and ionic bond.

晶格和基体粒子之间产生了键合作用,形成的键显示出共价键和离子键的混合性质。

Describe the lattice structure of ionic compounds as a regular arrangement of alternating positive and negative ions.

描述离子化学物晶格结构是由交替排列的正负离子规律的排布构成的。

Tounderstand its superconductivity, it is essential to study the bondstructure and electronic states in charged C〓. Based on a tight- binding model and the group analysis, we depict in detail the bondstructure and electronic states of charged C〓, and explain the split ofenergy levels and irreducible representation.

富勒球状碳家族的发现已在化学和物理学中形成了新的研究领域,特别是碱金属掺杂的〓还是Tc较高的超导体,国内外已形成了〓的研究热潮,实验表明,C〓超导体主要来源于电子〓声子相互作用,这要求对C〓的电子态和晶格振动有深入的研究。

The isobaric volumetric thermal expansion with rising temperature is determined according to the Classic Statistic Dynamics theory.

温度效应可以通过与温度和晶体势场相关的晶格平衡位置位移的热力学概率而引入热膨胀的计算中。

Comparing with montmorillonite, the layer structure of kaolinite is more perfect, less impurity.

与蒙脱石相比,晶格中杂质更少,具有更好的结构稳定性。

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