分子间作用中的强协同效应会对高能材料的晶体结构和重要性质产生重大影响。
The strong cooperative effect in the intermolecular interaction has a severe influence on the crystal structure and other important properties.
利用VASP软件包可计算形成能、相图、电压和材料的晶体结构参数及态密度等。
The formation energy, phase diagram, voltage, crystal structural parameter and density of state can be calculated using VASP software package.
借助XRD和TG - DTA等测试手段对材料的晶体结构和反应过程进行了分析。
The crystal structure and reaction progress were investigated with XRD and TG-DTA.
用蒸发凝聚法制备的金属超微粉末的晶体结构与大块材料的晶体结构基本一致，氧化物含量少。
Under the experiment conditions, the crystal structure of the as-prepared ultra-fine metallic powders is almost the same as that of the bulk metal without obvious oxidation.
用XRD、循环伏安、电化学阻抗谱(EIS)、恒流充放电测试研究了材料的晶体结构和电化学性能。
The crystal structure and electrochemical performance of the material were studied by XRD, cyclic voltammetry, electrochemical impedance spectroscopy (EIS) and galvanostatic charge-discharge tests.
根据铝活塞材料的晶体结构特点，巧妙地利用化学热处理方法，改善了活塞在气缸内运动时的摩擦学特性。
Considering the crystal structure characteristics, improving the piston tribological property during the operation in cylinder was reached by using chemical heat treatment skillfully.
制造一种好的热电材料的关键是，需要一种电子可以自由流动的晶体结构。
The trick to a good thermoelectric material is a crystal structure in which electrons can flow freely.
那就是为什么这些谎言隐藏在两种材料不同的晶体结构里。
Why that is so lies buried in the different crystalline structures of the two materials.
每个晶体结构由相间的二氧化硅层和高分子聚合材料层组成，相同材料层之间的间距与声子的波长相匹配。
Each crystal structure consists of alternating layers of silicon dioxide and a polymer material, so that the spacing between similar layers matches the wavelength of phonons.
这种钙钛矿是一种有机-无机杂化材料，具有能够非常高效地进行光电转换的晶体结构。
Perovskite is an organic-inorganic hybrid material with a crystal structure that is extraordinarily efficient for converting light into electricity.
由于纳米材料催化剂具有独特的晶体结构及表面特性，因而其催化活性和选择性大大高于传统催化剂。
Nanometer catalyst material had peculiar crystallographic structure and surface property, thus its catalytic activity and selectivity were too much greater than these of traditional catalyst.
钙钛矿是一种有特殊晶体结构的材料。
Perovskites are materials with a particular crystalline structure.
MWW结构分子筛是一类具有独特晶体结构的实用分子筛催化新材料。
MWW type zeolite is a kind of practical catalytic new material, which has special crystal structure.
利用化学键的观点定量地研究了一些具有各种晶体结构实用材料的介电性质。
From the chemical bond viewpoint, dielectric properties of some practical materials with various crystal structures were quantitatively studied.
晶材料晶体结构的重要参数。
Lattice parameters are the important crystal structural parameters of polycrystalline materials.
结果表明：ASB的形态、大小和数量受材料的预冷变形程度、 成分、晶体结构、相组成等因素的影响；
The results indicated that the shape, size and quantity of ASBs a re affected by the factors of pre-deformed degree, crystal structure, ph ase states etc.
另外，材料的表面形貌、晶体结构等表面性质也会影响其活性化能力。
In addition, the surface morphology and crystal structure also affect the films functional groups bioactivity.
从材料的多晶体结构角度，基于晶体塑性变形理论建立了多晶体模型。
From the viewpoint of multi-grain structure of material, a polycrystal model is founded based on the crystal plasticity theory.
并从陶瓷的晶体结构、陶瓷的成型与烧结、陶瓷的韧化等几个方面详细的介绍了陶瓷材料。
And from several forming crystal structure, ceramic and ceramic sintering, toughening, detailed introduction of the ceramic materials.
本工作所得到的结果对于分析晶体结构以及光电材料的染料增感等方面都有重要的参考价值。
The results of this work are valuable for the analysis of crystal structure, and can instruct the dye to be used in more fields such as spectral sensitization of photoelectric materials.
采用光学显微镜、XRD、SEM、TEM、SAED等手段，表征纳米材料的尺寸、形貌、组成和晶体结构。
Optical microscopy, XRD, SEM, tem and SAED are used to systemically characterize the morphology and structure of silver nanostructures.
采用光学显微镜、XRD、SEM、TEM、SAED等手段，表征纳米材料的尺寸、形貌、组成和晶体结构。
Optical microscopy, XRD, SEM, tem and SAED are used to systemically characterize the morphology and structure of silver nanostructures.
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