在MAS固态NMR中,在频率交换的Lee-Goldburg脱下,剩余线宽的起源
Johannes Hellwagner1, Liam Grunwald1, Manuel Ochsner1
1Physical Chemistry, ETH Zürich, 8093 Zürich, Switzerland.
在固态NMR脱中,残余线的扩大是显著的. 射频场的不均性是主要原因,而不是脉冲瞬态,即使在有限的样本大小,也会影响频率切换的Lee-Goldburg序列.
科学领域:
- 固态核磁共振 (NMR) 光谱学. 固态核磁共振 (NMR) 光谱学.
- 量子动力学和旋转物理学.
- 材料的表征技术. 材料的表征技术.
背景情况:
- 魔法角旋转 (MAS) NMR对于高分辨率固态分析至关重要.
- 同核分离序列的目的是缩小光谱线,但往往显示出比预测的更大的残余线宽.
- 频率切换的Lee-Goldburg (FSLG) 序列被广泛用于固态NMR中的脱.
研究的目的:
- 从理论和实验上研究在FSLG脱下剩余线路扩张的起源.
- 确定导致固态NMR线宽的主导错误来源.
- 在Floquet理论中分析脉冲形状错误和更高阶术语的影响.
主要方法:
- 应用Floquet理论来分析更高阶的误差术语.
- 脉冲形状错误的理论分析,包括脉冲瞬态和射频 (rf) 场异质.
- 使用受限样本和脉冲过渡补偿技术进行实验验证.
主要成果:
- 第三阶级的自动条款在FSLG脱下大大促进了线路的扩展.
- 无线电频率 (rf) 场的不均性被确定为剩余线路扩展的主要来源.
- 脉冲瞬态具有较小的作用,而三旋转项实际上是由脉冲序列的平均值.
结论:
- 固态NMR脱中的剩余线宽主要是由于RF场不均造成的.
- 了解和减轻这些错误源对于改善固态NMR的光谱分辨率至关重要.
- 这些发现对于优化FSLG序列实现,即使对于小样本量也很重要.
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