Accuracy of

Autor: Lokeswara Rao, Potnuru, Nghia Tuan, Duong, Sahil, Ahlawat, Sreejith, Raran-Kurussi, Matthias, Ernst, Yusuke, Nishiyama, Vipin, Agarwal
Rok vydání: 2020
Zdroj: The Journal of chemical physics. 153(8)
ISSN: 1089-7690
Popis: Selective recoupling of protons (SERP) is a method to selectively and quantitatively measure magnetic dipole-dipole interaction between protons and, in turn, the proton-proton distance in solid-state samples at fast magic-angle spinning. We present a bimodal operator-based Floquet approach to describe the numerically optimized SERP recoupling sequence. The description calculates the allowed terms in the first-order effective Hamiltonian, explains the origin of selectivity during recoupling, and shows how different terms are modulated as a function of the radio frequency amplitude and the phase of the sequence. Analytical and numerical simulations have been used to evaluate the effect of higher-order terms and offsets on the polarization transfer efficiency and quantitative distance measurement. The experimentally measured
Databáze: OpenAIRE