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相关概念视频

Spin–Spin Coupling: Two-Bond Coupling (Geminal Coupling)01:20

Spin–Spin Coupling: Two-Bond Coupling (Geminal Coupling)

981
Two NMR-active nuclei bonded to a central atom can be involved in geminal or two-bond coupling. Geminal coupling is commonly seen between diastereotopic protons in chiral molecules and unsymmetrical alkenes, among others.
The central atom need not be NMR-active because its electrons are affected by the electron polarization of the spin-active atoms. However, spin information is transmitted less effectively than in one-bond coupling, and 2J values are usually weaker than 1J values. The energy of...
981
Spin–Spin Coupling: One-Bond Coupling01:17

Spin–Spin Coupling: One-Bond Coupling

949
Coupling interactions are strongest between NMR-active nuclei bonded to each other, where spin information can be transmitted directly through the pair of bonding electrons. While nuclei polarize their electrons to the opposite spins, the bonding electron pair has opposite spins. Configurations with antiparallel nuclear spins are expected to be lower in energy. When coupling makes antiparallel states more favorable, J is considered to have a positive value. The one-bond coupling constant, 1J,...
949
Spin–Spin Coupling Constant: Overview01:08

Spin–Spin Coupling Constant: Overview

894
In bromoethane, the three methyl protons are coupled to the two methylene protons that are three bonds away. In accordance with the n+1 rule, the signal from the methyl protons is split into three peaks with 1:2:1 relative intensities. The methylene protons appear as a quartet, with the relative intensities of 1:3:3:1.
Qualitatively, any spin plus-half nucleus polarizes the spins of its electrons to the minus-half state. Consequently, the paired electron in the hydrogen–carbon bond must...
894
NMR Spectroscopy: Spin–Spin Coupling01:08

NMR Spectroscopy: Spin–Spin Coupling

1.3K
The spin state of an NMR-active nucleus can have a slight effect on its immediate electronic environment. This effect propagates through the intervening bonds and affects the electronic environments of NMR-active nuclei up to three bonds away; occasionally, even farther. This phenomenon is called spin–spin coupling or J-coupling. Coupling interactions are mutual and result in small changes in the absorption frequencies of both nuclei involved. While nuclei of the same element are involved...
1.3K
Spin–Spin Coupling: Three-Bond Coupling (Vicinal Coupling)01:22

Spin–Spin Coupling: Three-Bond Coupling (Vicinal Coupling)

1.0K
Vicinal or three-bond coupling is commonly observed between protons attached to adjacent carbons. Here, nuclear spin information is primarily transferred via electron spin interactions between adjacent C‑H bond orbitals. This generally favors the antiparallel arrangement of spins, so 3J values are usually positive.
The extent of coupling depends on the C‑C bond length, the two H‑C‑C angles, any electron-withdrawing substituents, and the dihedral angle between the...
1.0K
¹H NMR: Interpreting Distorted and Overlapping Signals01:02

¹H NMR: Interpreting Distorted and Overlapping Signals

1.0K
Spin systems where the difference in chemical shifts of the coupled nuclei is greater than ten times J are called first-order spin systems. These nuclei are weakly coupled, and their chemical shifts and coupling constant can generally be estimated from the well-separated signals in the spectrum.
As Δν decreases and the signals move closer, the doublets appear increasingly distorted. The intensities of the inner lines increase at the cost of those of the outer lines as the signals are...
1.0K

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相关实验视频

Updated: Jun 11, 2025

All-electronic Nanosecond-resolved Scanning Tunneling Microscopy: Facilitating the Investigation of Single Dopant Charge Dynamics
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在强自旋轨道合体制中的动态Jahn-Teller效应.

Ivica Živković1, Jian-Rui Soh2, Oleg Malanyuk2

  • 1Laboratory for Quantum Magnetism, Institute of Physics, École Polytechnique Fédérale de Lausanne, Lausanne, Switzerland. ivica.zivkovic@epfl.ch.

Nature communications
|October 3, 2024
PubMed
概括

这项研究揭示了Ba2MgReO6作为一个动态的Jahn-Teller系统在强大的旋转轨道合下. 它表明这种不稳定性会产生一个基本状态的双重状态,持续到低温.

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科学领域:

  • 凝聚物质物理学 凝聚物质物理学
  • 量子材料是一种量子材料.
  • 固态化学 固态化学

背景情况:

  • 奇特的量子相源于电荷,自旋,格子和轨道自由度的复杂相互作用.
  • Jahn-Teller 效应是一种纠行为形式,涉及格子扭曲,解除轨道退化.

研究的目的:

  • 为了研究5d1双矿Ba2MgReO6中的动态Jahn-Teller效应.
  • 探索动态Jahn-Teller效应和在强自旋轨道合体制中强烈相关的电子行为之间的相互作用.

主要方法:

  • 热力学实验热力学实验
  • 共振无弹性X射线散射 (RIXS) 是一种
  • 量子化学计算 量子化学计算

主要成果:

  • Ba2MgReO6在强自旋轨道合模式中表现出一个动态的Jahn-Teller系统.
  • 雅恩-泰勒的不稳定性驱动了基态双重,解决了这一类化合物的关键难题.
  • 动态的ReO6八面体在低温下持续存在,与多极秩序共存.

结论:

  • Ba2MgReO6是具有强大的旋转轨道合的动态Jahn-Teller系统的一个罕见例子.
  • 这些发现提供了关于动态Jahn-Teller效应和相关电子现象之间的相互作用的见解.