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相关概念视频

Potential Due to a Magnetized Object01:24

Potential Due to a Magnetized Object

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Magnetic dipoles in magnetic materials are aligned when placed under an external magnetic field. For paramagnets and ferromagnets, dipole alignment occurs in the direction of the magnetic field. However, the dipoles align opposite to the field in the case of diamagnets. This state of magnetic polarization due to the external field is called magnetization. Magnetization is defined as the dipole moment per unit volume. It plays a similar role to polarization in electrostatics.
The vector...
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Paramagnetism01:30

Paramagnetism

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Paramagnets are materials with unpaired electrons that possess a finite magnetic moment. In the absence of a magnetic field, these moments are randomly oriented, and thus the net moment is zero. Under an external field, a torque acting on the moments tends to align them along the field's direction. However, the random thermal motion of electrons produces a torque opposite to the external field and tries to disorient the moments. These two competing effects align only a few moments along the...
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Magnetic Susceptibility and Permeability01:31

Magnetic Susceptibility and Permeability

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In linear magnetic materials, like paramagnets and diamagnets, magnetization is proportional to the magnetic field intensity. The constant of proportionality, a dimensionless number, is called magnetic susceptibility. The value of the susceptibility depends on the type of material.
When diamagnetic materials are placed under an external magnetic field, the moments opposite to the field are induced. Hence, the susceptibility for diamagnets has a minimal negative value of 10-5–10-6. Since...
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Magnetic Vector Potential01:15

Magnetic Vector Potential

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In electrostatics, the electric field can be written as the negative gradient of the potential. In magnetostatics, the zero divergence of the magnetic field ensures that the magnetic field can be expressed as the curl of a vector potential. This potential is known as the magnetic vector potential.
Consider an ideal solenoid with n turns per unit length and radius R. If I is the current through the solenoid, the magnetic field inside the solenoid is expressed as the product of vacuum...
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Differential Form of Maxwell's Equations01:17

Differential Form of Maxwell's Equations

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James Clerk Maxwell (1831–1879) was one of the significant contributors to physics in the nineteenth century. He is probably best known for having combined existing knowledge of the laws of electricity and the laws of magnetism with his insights to form a complete overarching electromagnetic theory, represented by Maxwell's equations. The four basic laws of electricity and magnetism were discovered experimentally through the work of physicists such as Oersted, Coulomb, Gauss, and...
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Magnetic Fields01:27

Magnetic Fields

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A moving charge or a current creates a magnetic field in the surrounding space, in addition to its electric field. The magnetic field exerts a force on any other moving charge or current that is present in the field. Like an electric field, the magnetic field is also a vector field. At any position, the direction of the magnetic field is defined as the direction in which the north pole of a compass needle points.
A magnetic field is defined by the force that a charged particle experiences...
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相关实验视频

Updated: Mar 1, 2026

Optimizing Magnetic Force Microscopy Resolution and Sensitivity to Visualize Nanoscale Magnetic Domains
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超一般化梯度近似使得磁性变得更接近.

Jacques K Desmarais1, Alessandro Erba1, Giovanni Vignale2

  • 1Università di Torino, Dipartimento di Chimica, via Giuria 5, 10125 Torino, Italy.

Physical review letters
|March 28, 2025
PubMed
概括
此摘要是机器生成的。

这项研究引入了一种新的密度函数近似,可以改善材料中的磁性属性预测. 它为各种磁状态提供了准确性和计算成本之间的平衡.

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科学领域:

  • 计算材料科学 计算材料科学
  • 量子化学是一种量子化学.
  • 凝聚物质物理学 凝聚物质物理学

背景情况:

  • 密度函数理论 (DFT) 的近似值对于材料模拟至关重要.
  • 超一般化梯度近似 (MGGA) 代表了DFT准确度阶梯上的一个高阶.
  • 强烈受约束和适当规范 (SCAN) 的近似方法显示出有希望的结果,但在磁性特性方面存在困难.

研究的目的:

  • 开发一个改进的DFT近似,准确地描述铁磁,反铁磁和非线性磁态.
  • 为了解决在磁性系统的SCAN近似中观察到的过度磁化问题.
  • 为电子结构计算提供一种计算效率高且准确的方法.

主要方法:

  • 开发一种新的密度函数近似方法.
  • 纳入确切的条件和最少的经验规范.
  • 在晶体电子结构包中实现.

主要成果:

  • 新的近似成功地解决了SCAN的过度磁化问题.
  • 实现了对铁磁,反铁磁和非线性磁态的准确预测.
  • 该方法在准确性和计算成本之间取得了有利的平衡.

结论:

  • 开发的密度函数近似为研究磁性材料提供了可靠和准确的工具.
  • 这一进步预计将通过实现更精确的模拟,使计算材料科学受益.
  • 该实现可用于电子结构计算.