Automated optimization of spatial resolution for single-sided NMR

IF 1.9 3区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Magnetic Resonance in Chemistry Pub Date : 2023-04-20 DOI:10.1002/mrc.5352
Lyndi Kiple, John Ballenger, Kristina Keating, Anagi M. Balachandra, Tyler Meldrum
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Abstract

Single-sided NMR instruments utilize inhomogeneous magnetic fields with strong gradients to nondestructively probe physical properties of materials. The sensitive region of this type of magnet is often a thin slice above the magnet's surface; measuring planar samples with high spatial resolution requires coplanarity between the sensitive region of the magnet and the sample region of interest. We developed an algorithmic approach to position flat samples coplanar with the magnet's sensitive region. The efficient and objective positioning process utilizes an adjustable stage that offers control over three degrees of freedom, and the optimal position for each sample is found with a quadtree algorithm. We show this algorithm is effective for positioning samples with various relaxation behaviors. We report resolution values that describe position optimization, acquisition constraints, and final spatial resolution for each sample. Measurements after optimized positioning had appropriate spatial resolution to distinguish physical regions of layered samples with different physical properties, namely, relaxation behavior. Our algorithmic positioning process can be implemented for planar samples in research and industrial settings to enhance spatial resolution of single-sided NMR measurements.

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单面核磁共振空间分辨率的自动优化
单面核磁共振仪器利用强梯度的非均匀磁场对材料的物理性质进行无损探测。这种类型的磁铁的敏感区域通常是磁铁表面上的薄片;测量具有高空间分辨率的平面样品要求磁体的敏感区域和感兴趣的样品区域之间具有共平面性。我们开发了一种算法方法来定位平面样品与磁铁的敏感区域共面。有效和客观的定位过程利用可调节的阶段,提供了三个自由度的控制,每个样本的最佳位置是用四叉树算法找到的。结果表明,该算法对具有不同松弛行为的样本定位是有效的。我们报告了描述每个样本的位置优化、采集约束和最终空间分辨率的分辨率值。优化定位后的测量具有适当的空间分辨率,可以区分具有不同物理性质(即松弛行为)的层状样品的物理区域。我们的算法定位过程可用于研究和工业环境中的平面样品,以提高单面核磁共振测量的空间分辨率。
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来源期刊
CiteScore
4.70
自引率
10.00%
发文量
99
审稿时长
1 months
期刊介绍: MRC is devoted to the rapid publication of papers which are concerned with the development of magnetic resonance techniques, or in which the application of such techniques plays a pivotal part. Contributions from scientists working in all areas of NMR, ESR and NQR are invited, and papers describing applications in all branches of chemistry, structural biology and materials chemistry are published. The journal is of particular interest not only to scientists working in academic research, but also those working in commercial organisations who need to keep up-to-date with the latest practical applications of magnetic resonance techniques.
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