On the equivalence between different averaging schemes in magnetic resonance

被引:11
作者
Ganguly, Shreyan [1 ]
Garg, Rajat [1 ]
Ramachandran, Ramesh [1 ]
机构
[1] Indian Inst Sci Educ & Res IISER Mohali, Dept Chem Sci, Sect 81,Manauli POB 140306, Mohali, Punjab, India
关键词
SOLID-STATE NMR; SIDE-BAND; EFFECTIVE-HAMILTONIANS; SCHRODINGER-EQUATION; FLOQUET THEORY; SPIN; SPECTRA;
D O I
10.1063/5.0018753
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
Evolution of quantum mechanical systems under time-dependent Hamiltonians has remained a challenging problem of interest across all disciplines. Through suitable approximations, different averaging methods have emerged in the past for modeling the time-evolution under time-dependent Hamiltonians. To this end, the development of analytic methods in the form of time-averaged effective Hamiltonians has gained prominence over other methods. In particular, the advancement of spectroscopic methods for probing molecular structures has benefited enormously from such theoretical pursuits. Nonetheless, the validity of the approximations and the exactness of the proposed effective Hamiltonians have always remained a contentious issue. Here, in this report, we reexamine the equivalence between the effective Hamiltonians derived from the Magnus formula and Floquet theory through suitable examples in magnetic resonance.
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页数:21
相关论文
共 46 条
[31]   NMR IN ROTATING SOLIDS [J].
MARICQ, MM ;
WAUGH, JS .
JOURNAL OF CHEMICAL PHYSICS, 1979, 70 (07) :3300-3316
[32]  
Mehring M., 1983, Principles of High Resolution NMR in Solids
[33]  
Papousek D., 1982, Molecular Vibrational-Rotational Spectra: theory and applications of high resolution infrared, microwave, and Raman spectroscopy of polyatomic molecules
[34]   ON EXPONENTIAL FORM OF TIME-DISPLACEMENT OPERATORS IN QUANTUM MECHANICS [J].
PECHUKAS, P ;
LIGHT, JC .
JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (10) :3897-&
[35]   Multipole-multimode Floquet theory in nuclear magnetic resonance [J].
Ramachandran, R ;
Griffin, RG .
JOURNAL OF CHEMICAL PHYSICS, 2005, 122 (16)
[36]   Effective Hamiltonians in Floquet theory of magic angle spinning using van Vleck transformation [J].
Ramesh, R ;
Krishnan, MS .
JOURNAL OF CHEMICAL PHYSICS, 2001, 114 (14) :5967-5973
[37]   Floquet-van Vleck analysis of heteronuclear spin decoupling in solids: The effect of spinning and decoupling sidebands on the spectrum [J].
Sachleben, JR ;
Gaba, J ;
Emsley, L .
SOLID STATE NUCLEAR MAGNETIC RESONANCE, 2006, 29 (1-3) :30-51
[38]  
Sakurai J. J., 2011, Modern Quantum Mechanics
[39]   Operator-based Floquet theory in solid-state NMR [J].
Scholz, Ingo ;
van Beek, Jacco D. ;
Ernst, Matthias .
SOLID STATE NUCLEAR MAGNETIC RESONANCE, 2010, 37 (3-4) :39-59
[40]   SOLUTION OF SCHRODINGER EQUATION WITH A HAMILTONIAN PERIODIC IN TIME [J].
SHIRLEY, JH .
PHYSICAL REVIEW, 1965, 138 (4B) :B979-&