The perturbation formulas of g-factors g(parallel to) g(perpendicular to) and hyperfine structure constants A(parallel to), A(perpendicular to) for 3d(7) ion in trigonal octahedral crystal field are established on the basis of a cluster approach. These formulas consist of the contributions from configuration interaction and covalency effect and the parameters related to both effects can be estimated from the optical spectra and the structural data of the system under study. According to these formulas, the local trigonal distortion angle beta at pressure P = 0 and the local compressibilities d ln beta /dP in two pressure regions around Co2+ impurity in ZnSiF6. 6H(2)O crystal are estimated by fitting the calculated electron paramagnetic resonance parameters g,, Ai and their pressure coefficients to the observed values. The results show that these local values are different from those of the host crystal because of the influence of impurity. (C) 2001 Elsevier Science B.V. All rights reserved.
部门归属
sichuan univ, dept mat sci, chengdu 610064, peoples r china. chinese acad sci, int ctr mat phys, shenyang 110015, peoples r china.;zheng, wc (reprint author), sichuan univ, dept mat sci, chengdu 610064, peoples r china
W. C. Zheng,S. Y. Wu. Local structure and local compressibilities around Co2+ impurity in ZnSiF6 center dot 6H(2)O crystal determined from electron paramagnetic resonance data[J]. Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy,2001,57(6):1177-1182.
APA
W. C. Zheng,&S. Y. Wu.(2001).Local structure and local compressibilities around Co2+ impurity in ZnSiF6 center dot 6H(2)O crystal determined from electron paramagnetic resonance data.Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy,57(6),1177-1182.
MLA
W. C. Zheng,et al."Local structure and local compressibilities around Co2+ impurity in ZnSiF6 center dot 6H(2)O crystal determined from electron paramagnetic resonance data".Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy 57.6(2001):1177-1182.
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