Supercomputer analysis of one-dimensional multiple-quantum dynamics of nuclear spins in solids

被引：25

作者：

Doronin, SI ^{[1
]}

Fel'dman, EB ^{[1
]}

Guinzbourg, IY ^{[1
]}

Maximov, II ^{[1
]}

机构：

[1] Russian Acad Sci, Inst Problems Chem Phys, Chernogolovka 142432, Moscow Region, Russia

来源：

CHEMICAL PHYSICS LETTERS | 2001年 / 341卷 / 1-2期

基金：

俄罗斯基础研究基金会;

关键词：

D O I：

10.1016/S0009-2614(01)00472-9

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

We report the results of supercomputer simulations of multiple-quantum (MQ) NMR dynamics of linear nuclear spin chains of 12-15 spins coupled by the dipole-dipole interactions (DDI). The supercomputer simulations demonstrate that MQ dynamics of linear spin chains exhibits oscillatory behavior. MQ coherence growth in powders of noninteracting linear spin chains is also investigated. We compare the results of the supercomputer simulations in single-crystals and powders with the predictions of a phenomenological Gaussian approximation and the experimental data for MQ NMR dynamics in quasi-one-dimensional spin clusters in apatites. (C) 2001 Published by Elsevier Science B.V.

引用

页码：144 / 152

页数：9

共 22 条

[1]

Abragam A., 2002, PRINCIPLES NUCL MAGN

[2] MULTIPLE-QUANTUM DYNAMICS IN SOLID-STATE NMR [J].

BAUM, J ;

MUNOWITZ, M ;

GARROWAY, AN ;

PINES, A .

JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (05) :2015-2025

[3] Non-ergodic quasi-equilibria in short linear spin 1/2 chains [J].

Bruschweiler, R ;

Ernst, RR .

CHEMICAL PHYSICS LETTERS, 1997, 264 (3-4) :393-397

[4] H-1 and F-19 multiple-quantum NMR dynamics in quasi-one-dimensional spin clusters in apatites [J].

Cho, G ;

Yesinowski, JP .

JOURNAL OF PHYSICAL CHEMISTRY, 1996, 100 (39) :15716-15725

[5] MULTIPLE-QUANTUM NMR DYNAMICS IN THE QUASI-ONE-DIMENSIONAL DISTRIBUTION OF PROTONS IN HYDROXYAPATITE [J].

CHO, GG ;

YESINOWSKI, JP .

CHEMICAL PHYSICS LETTERS, 1993, 205 (01) :1-5

[6] Multiple-quantum dynamics of one-dimensional nuclear spin systems in solids [J].

Doronin, SI ;

Maksimov, II ;

Fel'dman, EB .

JOURNAL OF EXPERIMENTAL AND THEORETICAL PHYSICS, 2000, 91 (03) :597-609

[7] Regular and erratic quantum dynamics in spin 1/2 rings with an XY Hamiltonian [J].

Fel'dman, EB ;

Rudavets, MG .

CHEMICAL PHYSICS LETTERS, 1999, 311 (06) :453-458

[8] Nonergodic quasiequilibrium in nuclear magnetic resonance of infinite linear spin-1/2 chains [J].

Fel'dman, EB ;

Lacelle, S .

JOURNAL OF CHEMICAL PHYSICS, 1998, 108 (12) :4709-4713

[9] Multiple quantum nuclear magnetic resonance in one-dimensional quantum spin chains [J].

Feldman, EB ;

Lacelle, S .

JOURNAL OF CHEMICAL PHYSICS, 1997, 107 (18) :7067-7084

[10] Multiple quantum NMR spin dynamics in one-dimensional quantum spin chains [J].

Feldman, EB ;

Lacelle, S .

CHEMICAL PHYSICS LETTERS, 1996, 253 (1-2) :27-31

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