Superposition-model analysis of the second- and fourth-order spin-Hamiltonian parameters ofFe3+in the fluoroperovskite compounds. A new EPR study ofFe3+in KMgF3

1979 ◽  
Vol 19 (11) ◽  
pp. 5516-5524 ◽  
Author(s):  
H. Murrieta S. ◽  
J. Rubio O. ◽  
G. Aguilar S.
Keyword(s):  
Fourth Order ◽  
Model Analysis ◽  
Superposition Model ◽  
Spin Hamiltonian ◽  
Hamiltonian Parameters

Superposition Model Analysis of the Spin Hamiltonian Parameters of Two Gd3+ Doped Thorium Dichalcogenides

1982 ◽  
Vol 37 (6) ◽  
pp. 536-545
Author(s):  
G. Amoretti ◽  
C. Fava ◽  
V. Varacca
Keyword(s):  
Experimental Data ◽  
Single Crystal ◽  
Power Law ◽  
Model Analysis ◽  
Superposition Model ◽  
Spin Hamiltonian ◽  
Large Spread ◽  
Hamiltonian Parameters

Abstract The spin Hamiltonian parameters of Gd3+ in a single crystal of Thorium disulfide (ThS2) are analysed by means of the superposition model, in its most general form of a two exponents power law. In fact, the approximated one exponent power law is not suitable for this compound, where the ion-ligand distances show a quite large spread. The results of the analysis are then applied to the case of Gd3+ doped Thorium oxysulfide (ThOS), where the fitting of the experimental data is possible only assuming some distortion of the ligand cage.

Investigation of the Spin Hamiltonian Parameters of Yb3+ in CaWO4 Crystal

2004 ◽  
Vol 59 (12) ◽  
pp. 943-946 ◽  
Author(s):  
Hui-Ning Dong ◽  
Shao-Yi Wu
Keyword(s):  
Hyperfine Structure ◽  
Local Structure ◽  
Reasonable Agreement ◽  
Second Order ◽  
Order Perturbation ◽  
Superposition Model ◽  
Spin Hamiltonian ◽  
Structure Constants ◽  
Hamiltonian Parameters ◽  
G Factors

In this paper, the spin Hamiltonian parameters g factors g∥ and g⊥ of Yb3+ and hyperfine structure constants A∥ and A⊥ of 171Yb3+ and 173Yb3+ in CaWO4 crystal are calculated from the two-order perturbation formulae. In these formulae, the contributions of the covalence effects, the admixture between J =7/2 and J =5/2 states as well as the second-order perturbation are included. The needed crystal parameters are obtained from the superposition model and the local structure of the studied system. The calculated results are in reasonable agreement with the observed values. The results are discussed.

Theoretical Investigations Of The Spin Hamiltonian Parameters Of Zrsio4:Np4+

2004 ◽  
Vol 59 (7-8) ◽  
pp. 471-475
Author(s):  
Shao-Yi Wu ◽  
Hui-Ning Dong
Keyword(s):  
Experimental Data ◽  
Energy Levels ◽  
Structural Data ◽  
Superposition Model ◽  
Spin Hamiltonian ◽  
Theoretical Investigations ◽  
Structure Constants ◽  
Crystal Field Parameters ◽  
Hamiltonian Parameters ◽  
Theoretical Results

In this work, the spin Hamiltonian (SH) parameters g|| and g⊥, and the hyperfine structure constants A|| and A⊥ for ZrSiO4:Np4+ are investigated on the basis of the perturbation formulas of these parameters for a 5f3 ion in tetragonal (D2d) symmetry. In these formulas, the contributions to the SH parameters from the second-order perturbation terms, the admixtures of various energy levels and the covalency effect are taken into account. The related crystal-field parameters are calculated from the superposition model and the local structural data of the Zr4+ site occupied by the impurity Np4+. The calculated SH parameters agree reasonably with the experimental data. The validity of the theoretical results is discussed.

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