Theoretical study of the spin Hamiltonian parameters of vanadium ions V2+ in CsMgX3 (X = Cl, Br, I)
文献类型：期刊论文
| 作者 | X. Y. Gao ; S. Y. Wu ; W. H. Wei ; W. Z. Yan |
| 刊名 | Zeitschrift Fur Naturforschung Section a-a Journal of Physical Sciences
 |
| 出版日期 | 2005 |
| 卷号 | 60期号:3页码:145-148 |
| 关键词 | electron paramagnetic resonance (X = Cl crystal- and ligand-field theory Br V2+ I) CsMgX3 atomic screening constants scf functions csmgcl3 absorption pairs cr3+ |
| ISSN号 | 0932-0784 |
| 中文摘要 | The spin Hamiltonian g factors and the hyperfine structure constants for V2+ in CsMgX3 (X = Cl, Br, I) are theoretically studied by using the perturbation formulas of these parameters for a 3d(3) ion in octahedral symmetry, based on the cluster approach. In such formulas, the contributions from the s-orbitals of the ligands were usually neglected. Here they are taken into account. The theoretical results (particularly the g factor for CsMgI3) show a significant improvement compared with those in absence of the ligand s-orbital contributions in the previous studies. |
| 原文出处 | |
| 公开日期 | 2012-04-14 |
| 源URL | [http://ir.imr.ac.cn/handle/321006/34846]  |
| 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 | X. Y. Gao,S. Y. Wu,W. H. Wei,et al. Theoretical study of the spin Hamiltonian parameters of vanadium ions V2+ in CsMgX3 (X = Cl, Br, I)[J]. Zeitschrift Fur Naturforschung Section a-a Journal of Physical Sciences,2005,60(3):145-148. |
| APA | X. Y. Gao,S. Y. Wu,W. H. Wei,&W. Z. Yan.(2005).Theoretical study of the spin Hamiltonian parameters of vanadium ions V2+ in CsMgX3 (X = Cl, Br, I).Zeitschrift Fur Naturforschung Section a-a Journal of Physical Sciences,60(3),145-148. |
| MLA | X. Y. Gao,et al."Theoretical study of the spin Hamiltonian parameters of vanadium ions V2+ in CsMgX3 (X = Cl, Br, I)".Zeitschrift Fur Naturforschung Section a-a Journal of Physical Sciences 60.3(2005):145-148. |
入库方式： OAI收割
来源：金属研究所
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