THERMODYNAMIC MODEL OF THE INSULATOR-METAL TRANSITION IN NICKEL IODIDE

被引:14
作者
FREERICKS, JK
FALICOV, LM
机构
[1] UNIV CALIF BERKELEY,DEPT PHYS,BERKELEY,CA 94720
[2] UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DIV MAT SCI,BERKELEY,CA 94720
来源
PHYSICAL REVIEW B | 1992年 / 45卷 / 04期
关键词
D O I
10.1103/PhysRevB.45.1896
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
A model calculation of the phase diagram for the isostructural insulator-metal phase transition of nickel iodide is presented. The system is modeled by the Falicov-Kimball Hamiltonian with the calculated band structure of NiL2 and (Ising) spin-spin interactions, but neglects all hybridization effects between nickel 3d and iodine 5p bands. Many-body interactions and spin superexchange are both treated in mean-field theory. The results include second-order antiferromagnetic-paramagnetic insulator transitions, first-order insulator-metal transitions, and a (as yet unobserved and probably unobservable) classical critical point. The calculated phase diagram and transport properties agree well with the recent experimental results.
引用
收藏
页码:1896 / 1899
页数:4
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