Jove
Visualize
联系我们
JoVE
x logofacebook logolinkedin logoyoutube logo
关于 JoVE
概览领导团队博客JoVE 帮助中心
作者
出版流程编辑委员会范围与政策同行评审常见问题投稿
图书馆员
用户评价订阅访问资源图书馆顾问委员会常见问题
研究
JoVE JournalMethods CollectionsJoVE Encyclopedia of Experiments存档
教育
JoVE CoreJoVE BusinessJoVE Science EducationJoVE Lab Manual教师资源中心教师网站
使用条款与条件
隐私政策
政策

相关概念视频

Atomic Nuclei: Nuclear Relaxation Processes01:23

Atomic Nuclei: Nuclear Relaxation Processes

632
In the absence of an external magnetic field, nuclear spin states are degenerate and randomly oriented. When a magnetic field is applied, the spins begin to precess and orient themselves along (lower energy) or against (higher energy) the direction of the field. At equilibrium, a slight excess population of spins exists in the lower energy state. Because the direction of the magnetic field is fixed as the z-axis,  the precessing magnetic moments are randomly oriented around the z-axis.
632
Atomic Nuclei: Nuclear Spin State Overview01:03

Atomic Nuclei: Nuclear Spin State Overview

891
NMR-active nuclei have energy levels called 'spin states' that are associated with the orientations of their nuclear magnetic moments. In the absence of a magnetic field, the nuclear magnetic moments are randomly oriented, and the spin states are degenerate. When an external magnetic field is applied, the spin states have only 2 + 1 orientations available to them. A proton with = ½ has two available orientations. Similarly, for a quadrupolar nucleus with a nuclear spin value of...
891
Mass Analyzers: Common Types01:19

Mass Analyzers: Common Types

579
The quadrupole mass analyzer consists of four cylindrical metal rods arranged in a diamond carrying a DC voltage and a radio-frequency AC voltage. The motion of ions through the quadrupole depends on the field strength, causing only ions of a certain m/z to resonate successfully and strike the detector at a given field strength. Though the transmission rate for these analyzers is high, the exact elemental composition of the sample is not determined because of low resolution; however, they are...
579
The Quantum-Mechanical Model of an Atom02:45

The Quantum-Mechanical Model of an Atom

42.0K
Shortly after de Broglie published his ideas that the electron in a hydrogen atom could be better thought of as being a circular standing wave instead of a particle moving in quantized circular orbits, Erwin Schrödinger extended de Broglie’s work by deriving what is now known as the Schrödinger equation. When Schrödinger applied his equation to hydrogen-like atoms, he was able to reproduce Bohr’s expression for the energy and, thus, the Rydberg formula governing hydrogen spectra.
42.0K
Atomic Nuclei: Types of Nuclear Relaxation01:28

Atomic Nuclei: Types of Nuclear Relaxation

268
Nuclear relaxation restores the equilibrium population imbalance and can occur via spin–lattice or spin–spin mechanisms, which are first-order exponential decay processes.
In spin–lattice or longitudinal relaxation, the excited spins exchange energy with the surrounding lattice as they return to the lower energy level. Among several mechanisms that contribute to spin–lattice relaxation, magnetic dipolar interactions are significant. Here, the excited nucleus transfers...
268
Atomic Nuclei: Nuclear Spin State Population Distribution01:14

Atomic Nuclei: Nuclear Spin State Population Distribution

956
Near absolute zero temperatures, in the presence of a magnetic field, the majority of nuclei prefer the lower energy spin-up state to the higher energy spin-down state. As temperatures increase, the energy from thermal collisions distributes the spins more equally between the two states. The Boltzmann distribution equation gives the ratio of the number of spins predicted in the spin −½ (N−) and spin +½ (N+) states.
956

您也可能阅读

相关文章

通过共同作者、期刊和引用图与本文相关的文章。

排序
Same author

Vibrational Properties of Hydroperoxyl Radical-Water Clusters Using Quantum Algorithms for Wavepacket Dynamics.

The journal of physical chemistry. A·2026
Same author

Ion-Based Characterization of Laser Beam Profiles for Quantum Information Processing.

Entropy (Basel, Switzerland)·2025
Same author

Adaptive AI-enhanced computation offloading with machine learning for QoE optimization and energy-efficient mobile edge systems.

Scientific reports·2025
Same author

Quantum Circuit and Mapping Algorithms for Wavepacket Dynamics: Case Study of Anharmonic Hydrogen Bonds in Protonated and Hydroxide Water Clusters.

Journal of chemical theory and computation·2025
Same author

Resource Optimization for Quantum Dynamics with Tensor Networks: Quantum and Classical Algorithms.

The journal of physical chemistry. A·2024
Same author

Rare Events Sampling Methods for Quantum and Classical Ab Initio Molecular Dynamics.

The journal of physical chemistry. A·2024

相关实验视频

Updated: Jun 10, 2025

Experimental Methods for Trapping Ions Using Microfabricated Surface Ion Traps
11:45

Experimental Methods for Trapping Ions Using Microfabricated Surface Ion Traps

Published on: August 17, 2017

14.4K

分布式离子陷量子计算系统上的量子核动力学

Anurag Dwivedi1,2, A J Rasmusson2,3, Philip Richerme2,3

  • 1Department of Chemistry, Indiana University, Bloomington, Indiana 47405, United States.

Journal of the American Chemical Society
|October 16, 2024
PubMed
概括
此摘要是机器生成的。

这项研究在被困离子量子计算机上展示了量子核动力学, 实现了分子振动光谱的化学精度. 它开创了复杂化学动力学模拟的分布式量子计算.

更多相关视频

All-electronic Nanosecond-resolved Scanning Tunneling Microscopy: Facilitating the Investigation of Single Dopant Charge Dynamics
11:33

All-electronic Nanosecond-resolved Scanning Tunneling Microscopy: Facilitating the Investigation of Single Dopant Charge Dynamics

Published on: January 19, 2018

9.5K
Gradient Echo Quantum Memory in Warm Atomic Vapor
10:00

Gradient Echo Quantum Memory in Warm Atomic Vapor

Published on: November 11, 2013

12.8K

相关实验视频

Last Updated: Jun 10, 2025

Experimental Methods for Trapping Ions Using Microfabricated Surface Ion Traps
11:45

Experimental Methods for Trapping Ions Using Microfabricated Surface Ion Traps

Published on: August 17, 2017

14.4K
All-electronic Nanosecond-resolved Scanning Tunneling Microscopy: Facilitating the Investigation of Single Dopant Charge Dynamics
11:33

All-electronic Nanosecond-resolved Scanning Tunneling Microscopy: Facilitating the Investigation of Single Dopant Charge Dynamics

Published on: January 19, 2018

9.5K
Gradient Echo Quantum Memory in Warm Atomic Vapor
10:00

Gradient Echo Quantum Memory in Warm Atomic Vapor

Published on: November 11, 2013

12.8K

科学领域:

  • 量子计算
  • 化学动力学
  • 分子光谱学

背景情况:

  • 量子核动力学对古典系统来说是一个很大的计算挑战.
  • 量子信息处理为这些难以解决的问题提供了潜在的解决方案.
  • 具有键的系统表现出对化学反应至关重要的复杂质子动力学.

研究的目的:

  • 通过使用被困离子量子计算机实验模拟量子核波动.
  • 研究短强结系统中的共享质子动力学.
  • 展示分布式量子计算在化学动力学中的首次应用.

主要方法:

  • 使用IonQ的11个量子位的量子计算机,
  • 沿着潜在能量表面模拟量子核波段的演变.
  • 在分布式量子计算中采用张量网络形式.
  • 提取了时间依赖的空间投影和振动频率.

主要成果:

  • 在实验量子结果和波束动态的经典模拟之间取得了良好的一致性.
  • 获得的振动固有能量具有化学准确性 (在0.1kcal/mol的经典模拟范围内).
  • 在一个分布式的离子陷量子计算机中成功演示了并行量子计算.

结论:

  • 开发的方法为研究分子量子化学动力学和振动谱提供了一个新的范式.
  • 这项工作验证了量子计算机用于模拟复杂的化学现象.
  • 介绍了分布式量子计算在化学动力学领域的首次成功应用.