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X-ray Crystallography02:18

X-ray Crystallography

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The size of the unit cell and the arrangement of atoms in a crystal may be determined from measurements of the diffraction of X-rays by the crystal, termed X-ray crystallography.
Diffraction
Diffraction is the change in the direction of travel experienced by an electromagnetic wave when it encounters a physical barrier whose dimensions are comparable to those of the wavelength of the light. X-rays are electromagnetic radiation with wavelengths about as long as the distance between neighboring...
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X-ray Diffraction of Biological Samples01:10

X-ray Diffraction of Biological Samples

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X-ray diffraction or XRD is an analytical tool that utilizes X-rays to study ordered structures such as crystalline organic and inorganic samples, polycrystalline materials, proteins, carbohydrates, and drugs.
According to Bragg's law, when X-rays strike the sample positioned on a stage, the rays are  scattered by the electron clouds around the sample atoms. The  X-ray diffraction or scattering is caused by constructive interference of the X-ray waves that reflect off the internal...
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Polymer Classification: Crystallinity01:21

Polymer Classification: Crystallinity

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Unlike ionic or small covalent molecules, polymers do not form crystalline solids due to the diffusion limitations of their long-chain structures. However, polymers contain microscopic crystalline domains separated by amorphous domains.
Crystalline domains are the regions where polymer chains are aligned in an orderly manner and held together in proximity by intermolecular forces. For example, chains in the crystalline domains of polyethylene and nylon are bound together by van der Waals...
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Updated: Jun 12, 2025

Characterization of Ultra-fine Grained and Nanocrystalline Materials Using Transmission Kikuchi Diffraction
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在多晶体中进行内粒散射.

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  • 1Shell Global Solutions US, Inc., 3333 Highway 6 South, Houston, TX 77082, United States of America.

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概括
此摘要是机器生成的。

多晶体中的电导率在临界的晶体间偏差处显著增加,这是由于量子散射和费什巴赫共振. 这种传输现象取决于温度,为电子表面状态提供了洞察力.

关键词:
费什巴赫的共振是什么意思运输公司运输运营商运输运输连接的频道是合的.谷物边界的谷物边界是什么它是多晶体的.散射散射是一种散射.这是一个 varistor.

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科学领域:

  • 凝聚物质物理学 凝聚物质物理学
  • 量子力学就是量子力学.
  • 材料科学 是一种材料科学.

背景情况:

  • 多晶体中的运输现象对于材料特性至关重要.
  • 了解谷物边界效应是预测材料行为的关键.
  • 量子散射理论为电子运输提供了一个基本的方法.

研究的目的:

  • 从第一个原则来模拟通过多晶粒边界的电子运输.
  • 为了研究费什巴赫共振在电子表面状态中的作用.
  • 计算电导率并分析其依赖于谷间偏差和温度的情况.

主要方法:

  • 使用量子散射理论.
  • 导出一个有效的T矩阵.
  • 包括Feshbach共振来模拟被困的电子表面状态.
  • 计算电导率. 电导率的计算.

主要成果:

  • 电导率表现出断裂,在一个关键的谷间偏差处急剧增加.
  • 在特定条件下 (kBT << φb),导电率遵循 σ∼T-1/2e-φb/kBT.
  • 对于高热能模式,分析了导电性的温度依赖.

结论:

  • 该研究提供了通过谷物边界运输的第一原则描述.
  • 费什巴赫共振显著影响电子表面状态和导电性.
  • 导电率公式为多晶体在不同条件下的行为提供了预测能力.