| Theoretical Investigations of the Local Structure Distortion and EPR Parameter for Ni2+-doped Perovskite Fluorides | |
| Cao, Xi-min1; Kuang, Xiao-yu1,2; Li, Cheng-gang1; Chai, Rui-peng1 | |
| Corresponding Author | Kuang, Xiao-yu(scu_kxy@163.com) |
| 2011-04-01 | |
| Source Publication | CHINESE JOURNAL OF CHEMICAL PHYSICS
 |
| ISSN | 1674-0068 |
| Volume | 24Issue:2Pages:167-172 |
| Abstract | By analyzing the optical spectra and electron paramagnetic resonance parameter D, the local structure distortion of (NiF6)(4-) clusters in AMF(3) (A=K, Rb; M=Zn, Cd, Ca) and K2ZnF4 series are studied using the complete energy matrix based on the double spin-orbit coupling parameter model for configuration ions in a tetragonal ligand field. The results indicate that the contribution of ligand to spin-orbit coupling interaction should be considered for our studied systems. Moreover, the relationships between D and the spin-obit coupling coefficients as well as the average parameter and the divergent parameter are discussed. |
| Keyword | Complete energy matrix Double spin-orbit coupling parameter model Local structure distortion |
| DOI | 10.1088/1674-0068/24/02/167-172 |
| Indexed By | SCI |
| Language | 英语 |
| WOS Research Area | Physics |
| WOS Subject | Physics, Atomic, Molecular & Chemical |
| WOS ID | WOS:000290478500009 |
| Publisher | CHINESE PHYSICAL SOC |
| Citation statistics | |
| Document Type | 期刊论文 |
| Identifier | http://ir.imr.ac.cn/handle/321006/104730 |
| Collection | 中国科学院金属研究所 |
| Corresponding Author | Kuang, Xiao-yu |
| Affiliation | 1.Sichuan Univ, Inst Atom & Mol Phys, Chengdu 610065, Peoples R China 2.Chinese Acad Sci, Int Ctr Mat Phys, Shenyang 110016, Peoples R China |
| Recommended Citation GB/T 7714 | Cao, Xi-min,Kuang, Xiao-yu,Li, Cheng-gang,et al. Theoretical Investigations of the Local Structure Distortion and EPR Parameter for Ni2+-doped Perovskite Fluorides[J]. CHINESE JOURNAL OF CHEMICAL PHYSICS,2011,24(2):167-172. |
| APA | Cao, Xi-min,Kuang, Xiao-yu,Li, Cheng-gang,&Chai, Rui-peng.(2011).Theoretical Investigations of the Local Structure Distortion and EPR Parameter for Ni2+-doped Perovskite Fluorides.CHINESE JOURNAL OF CHEMICAL PHYSICS,24(2),167-172. |
| MLA | Cao, Xi-min,et al."Theoretical Investigations of the Local Structure Distortion and EPR Parameter for Ni2+-doped Perovskite Fluorides".CHINESE JOURNAL OF CHEMICAL PHYSICS 24.2(2011):167-172. |
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