Spin distribution and hydrogen-bond effect in ferromagnetic alpha-phase crystal of 2-(2 ',5(')-dihydroxyphenyl)-4,4,5,5-tetramethyl-4,5-dihydro-1H-imidazolyl-1- oxy-3-oxide
文献类型：期刊论文
| 作者 | Y. S. Zhang ; K. L. Yao ; Z. L. Liu ; L. H. Yu ; X. L. Wang |
| 刊名 | Journal of Chemical Physics
 |
| 出版日期 | 2006 |
| 卷号 | 124期号:14 |
| 关键词 | nitronyl nitroxide organic ferromagnet neutron-diffraction radicals density temperature transition magnets |
| ISSN号 | 0021-9606 |
| 中文摘要 | The ferromagnetic phenyl nitronyl nitroxide derivate alpha-phase 2-(2('),5(')-dihydroxyphenyl)- 4,4,5,5-tetramethyl-4,5-dihydro-1H-imidazolyl-1-oxy-3-oxide has been studied by the electronic structure calculation based on the density functional theory. The result shows that the spin delocalization due to hyperconjugation effect plays an important role in the spin distribution and ferromagnetic coupling of the crystal. |
| 原文出处 | |
| 公开日期 | 2012-04-14 |
| 源URL | [http://ir.imr.ac.cn/handle/321006/34727]  |
| 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 | Y. S. Zhang,K. L. Yao,Z. L. Liu,et al. Spin distribution and hydrogen-bond effect in ferromagnetic alpha-phase crystal of 2-(2 ',5(')-dihydroxyphenyl)-4,4,5,5-tetramethyl-4,5-dihydro-1H-imidazolyl-1- oxy-3-oxide[J]. Journal of Chemical Physics,2006,124(14). |
| APA | Y. S. Zhang,K. L. Yao,Z. L. Liu,L. H. Yu,&X. L. Wang.(2006).Spin distribution and hydrogen-bond effect in ferromagnetic alpha-phase crystal of 2-(2 ',5(')-dihydroxyphenyl)-4,4,5,5-tetramethyl-4,5-dihydro-1H-imidazolyl-1- oxy-3-oxide.Journal of Chemical Physics,124(14). |
| MLA | Y. S. Zhang,et al."Spin distribution and hydrogen-bond effect in ferromagnetic alpha-phase crystal of 2-(2 ',5(')-dihydroxyphenyl)-4,4,5,5-tetramethyl-4,5-dihydro-1H-imidazolyl-1- oxy-3-oxide".Journal of Chemical Physics 124.14(2006). |
入库方式： OAI收割
来源：金属研究所
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