Theoretical investigations of the spin Hamiltonian parameters for LiF:Mn(2+)
文献类型:期刊论文
作者 | L. L. Li ; S. Y. Wu ; M. Q. Kuang |
刊名 | Optik
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出版日期 | 2011 |
卷号 | 122期号:22页码:2026-2028 |
关键词 | Electron paramagnetic resonance Defect and impurities Mn(2+) LiF atomic screening constants scf functions ions |
ISSN号 | 0030-4026 |
中文摘要 | The spin Hamiltonian (SH) parameters (g factor, the hyperfine structure constant A as well as the superhyperfine parameters A' and B') for LiF:Mn(2+) are theoretically investigated from the perturbation formulas of these parameters for a 3d(5) ion under ideal octahedra. The related molecular orbital coefficients and the unpaired spin densities of the fluorine 2s, 2p sigma and 2p pi orbitals are quantitatively determined from the cluster approach in a uniform way. The calculated SH parameters show good agreement with the experimental data. The results are discussed. (C) 2011 Published by Elsevier GmbH. |
原文出处 | |
公开日期 | 2012-04-13 |
源URL | [http://210.72.142.130/handle/321006/30471] ![]() |
专题 | 金属研究所_中国科学院金属研究所 |
推荐引用方式 GB/T 7714 | L. L. Li,S. Y. Wu,M. Q. Kuang. Theoretical investigations of the spin Hamiltonian parameters for LiF:Mn(2+)[J]. Optik,2011,122(22):2026-2028. |
APA | L. L. Li,S. Y. Wu,&M. Q. Kuang.(2011).Theoretical investigations of the spin Hamiltonian parameters for LiF:Mn(2+).Optik,122(22),2026-2028. |
MLA | L. L. Li,et al."Theoretical investigations of the spin Hamiltonian parameters for LiF:Mn(2+)".Optik 122.22(2011):2026-2028. |
入库方式: OAI收割
来源:金属研究所
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