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Journal ArticleDOI

Theory and simulations of homonuclear spin pair systems in rotating solids

Malcolm H. Levitt, +3 more
- 01 Jun 1990 - 
- Vol. 92, Iss: 11, pp 6347-6364
TLDR
The theory of nuclear magnetic resonance (NMR) on a solid sample containing pairs of coupled homonuclear spins 1/2, rotating in a large magnetic field, is presented in this paper, where the time dependence introduced by the sample rotation, in conjunction with the spin-spin coupling, makes it appear that each of the central two levels in the four level system split into a pair of virtual states.
Abstract
The theory of nuclear magnetic resonance (NMR) on a solid sample containing pairs of coupled homonuclear spins‐1/2, rotating in a large magnetic field, is presented. The time dependence introduced by the sample rotation, in conjunction with the spin–spin coupling, makes it appear that each of the central two levels in the four‐level system split into a pair of ‘‘virtual states.’’ Each of the eight possible single‐quantum coherences between the virtual states and the two outer levels in general contribute to the spectrum, although four of these contributions are forbidden unless a rotational resonance occurs (matching of an integer multiple of the spinning speed with the difference in isotropic shifts). Analytical line shapes for the case of vanishing shift anisotropy are given and techniques for numerical simulation in the general case demonstrated. The theory of Zeeman magnetization exchange in the presence of zero‐quantum dephasing is presented.

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Citations
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Journal ArticleDOI

SIMPSON: a general simulation program for solid-state NMR spectroscopy.

TL;DR: The program is designed to emulate a NMR spectrometer by letting the user specify high-level NMR concepts such as spin systems, nuclear spin interactions, RF irradiation, free precession, phase cycling, coherence-order filtering, and implicit/explicit acquisition using the Tcl scripting language.
Journal ArticleDOI

Chemical shift correlation spectroscopy in rotating solids: Radio frequency‐driven dipolar recoupling and longitudinal exchange

TL;DR: In this paper, a new method of performing chemical shift correlation spectroscopy in solids with magic angle spinning (MAS) is presented. But the method is not suitable for the case of alanine.
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Broadband dipolar recoupling in the nuclear magnetic resonance of rotating solids: A compensated C7 pulse sequence

TL;DR: In this paper, an improved variant of the C7 pulse-sequence for efficient recoupling of spin-1/2 pair dipolar interactions in magic-angle spinning solid-state NMR spectroscopy is introduced.
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SPINEVOLUTION: A powerful tool for the simulation of solid and liquid state NMR experiments

TL;DR: SPINEVOLUTION is a versatile and easy to use tool for the simulation and optimization of virtually any NMR experiment and is consistently found to be orders of magnitude faster than another recently developed NMR simulation package, SIMPSON.
References
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Journal ArticleDOI

Quantal phase factors accompanying adiabatic changes

TL;DR: In this article, it was shown that the Aharonov-Bohm effect can be interpreted as a geometrical phase factor and a general formula for γ(C) was derived in terms of the spectrum and eigen states of the Hamiltonian over a surface spanning C.
Book

Principles of nuclear magnetic resonance in one and two dimensions

TL;DR: In this paper, the dynamics of nuclear spin systems were studied by two-dimensional exchange spectroscopy and nuclear magnetic resonance imaging (NEMI) imaging, and two different correlation methods based on coherence transfer were proposed.
Journal ArticleDOI

Proton‐enhanced NMR of dilute spins in solids

TL;DR: In this article, the NMR signals of isotopically or chemically dilute nuclear spins S in solids can be enhanced by repeatedly transferring polarization from a more abundant species I of high abundance (usually protons) to which they are coupled.
Journal ArticleDOI

Solution of the Schrödinger Equation with a Hamiltonian Periodic in Time

TL;DR: In this article, the interaction of a quantum system with an oscillating field is studied in a formalism which replaces the semiclassical time-dependent Hamiltonian with a time-independent Hamiltonian represented by an infinite matrix.
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