Ab initio/MBPT Studies of the Effective Exchange Integrals and Theoretical Models of Organic Ferromagnets

作     者：Li Jiabo (Department of Chemistry, Xiamen University, Xiamen) 

出 版 物：《Chemical Research in Chinese Universities》 (高等学校化学研究（英文版）)

年 卷 期：1991年第7卷第3期

页      面：181-183页

核心收录：

学科分类：07[理学] 0703[理学-化学] 

主　　题：Organic ferromagnet(OFM) Doping Curie temperature 

摘      要：Nowadays the studies of organize ferromagnets have been becoming a very attractive area of material science in both theoretical and experimental aspects. A major theoretical problem on design of OFM is to estimate the effective exchange integrals(J) between radical sites. However, most of theoretical work was on hypothetical hydrocarbons, which were impracticable in the synthesis. The recent breakthrough in the synthesis of OFM turns the theorist’s attention to some more realistic models such as those