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用于快速MAS固态化学位移相关核磁共振光谱的高功率宽带180度脉冲和混合序列设计。

Design of high-power, broadband 180 degrees pulses and mixing sequences for fast MAS solid state chemical shift correlation NMR spectroscopy.

作者信息

Herbst Christian, Herbst Jirada, Kirschstein Anika, Leppert Jörg, Ohlenschläger Oliver, Görlach Matthias, Ramachandran Ramadurai

机构信息

Leibniz Institute for Age Research, Fritz Lipmann Institute, Jena, Germany.

出版信息

J Biomol NMR. 2009 Jan;43(1):51-61. doi: 10.1007/s10858-008-9292-9. Epub 2008 Nov 19.

Abstract

An approach for the design of high-power, broadband 180 degrees pulses and mixing sequences for generating dipolar and scalar coupling mediated (13)C-(13)C chemical shift correlation spectra of isotopically labelled biological systems at fast magic-angle spinning frequencies without (1)H decoupling during mixing is presented. Considering RF field strengths in the range of 100-120 kHz, as typically available in MAS probes employed at high spinning speeds, and limited B (1) field inhomogeneities, the Fourier coefficients defining the phase modulation profile of the RF pulses were optimised numerically to obtain broadband inversion and refocussing pulses and mixing sequences. Experimental measurements were carried out to assess the performance characteristics of the mixing sequences reported here.

摘要

提出了一种用于设计高功率、宽带180°脉冲和混合序列的方法,该方法可在快速魔角旋转频率下,在混合过程中不进行¹H去耦的情况下,生成同位素标记生物系统的偶极和标量耦合介导的¹³C-¹³C化学位移相关谱。考虑到在高旋转速度下使用的MAS探头中通常可获得的100-120 kHz范围内的射频场强以及有限的B₁场不均匀性,对定义射频脉冲相位调制轮廓的傅里叶系数进行了数值优化,以获得宽带反转和重聚焦脉冲以及混合序列。进行了实验测量以评估本文报道的混合序列的性能特征。

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