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Updated: Jan 18, 2026

Atomic Scale Structural Studies of Macromolecular Assemblies by Solid-state Nuclear Magnetic Resonance Spectroscopy
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固态系统的NMR化学屏蔽使用自旋轨道合的ZORA GIPAW

T Speelman1, M-T Huebsch2, R W A Havenith3,4

  • 1Radboud University, Institute for Molecules and Materials, Heyendaalseweg 135, NL-6525 AJ Nijmegen, The Netherlands.

The Journal of chemical physics
|September 11, 2025
PubMed
概括

我们开发了一种新方法来计算核磁共振化学屏蔽电位子,使用固态系统中的自旋轨道合 (SOC). 这种方法准确地模拟了,和等重元素的相对论效应.

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