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

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	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
	Y. S. Zhang ; K. L. Yao ; Z. L. Liu ; L. H. Yu ; X. L. Wang
刊名	Journal of Chemical Physics
	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	://WOS:000236796700066
公开日期	2012-04-14
内容类型	期刊论文
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).