4.6 Article

Charge ordering in θ-(BEDT-TTF)2RbZn(SCN)4:: Cooperative effects of electron correlations and lattice distortions

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PHYSICAL REVIEW B
卷 75, 期 24, 页码 -

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AMERICAN PHYSICAL SOC
DOI: 10.1103/PhysRevB.75.245112

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Combined effects of electron correlations and lattice distortions on the charge ordering in theta-(BEDT-TTF)(2)RbZn(SCN)(4) are investigated theoretically in a two-dimensional 3/4-filled extended Hubbard model with electron-lattice couplings. It is known that this material undergoes a phase transition from a high-symmetry metallic state to a low-symmetry insulating state with a horizontal-stripe charge order (CO) by lowering temperature. By means of the exact-diagonalization method, we show that electron-phonon interactions are crucial to stabilize the horizontal-stripe CO and to realize the low-symmetry crystal structure.

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