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We theoretically study the competition among different electronic phases in molecular conductors $\kappa$-(BEDT-TTF)$_2$X. The ground-state properties of a 3/4-filled extended Hubbard model with the $\kappa$-type geometry are investigated…

超导电性 · 物理学 2017-02-10 Hiroshi Watanabe , Hitoshi Seo , Seiji Yunoki

We theoretically study hydrogen-bonded molecular conductors synthesized recently, $\kappa$-H$_3$(Cat-EDT-TTF)$_2$ and its diselena analog, $\kappa$-H$_3$(Cat-EDT-ST)$_2$, by first-principles density-functional theory calculations. In these…

强关联电子 · 物理学 2015-07-08 Takao Tsumuraya , Hitoshi Seo , Reizo Kato , Tsuyoshi Miyazaki

We study the electronic and structural properties of the low-temperature ordered phase of hydrogen-bonded molecular conductors, $\kappa$-D$_3$(Cat-EDT-TTF)$_2$ and its selenium-substituted analog $\kappa$-D$_3$(Cat-EDT-ST)$_2$, by means of…

强关联电子 · 物理学 2020-01-17 Takao Tsumuraya , Hitoshi Seo , Tsuyoshi Miyazaki

The polarized optical reflectance spectra of the quasi two dimensional organic correlated electron system $\kappa$-(BEDT-TTF)$_{2}$Cu[N(CN)$_{2}$]$Y$, $Y =$ Br and Cl are measured in the infrared region. The former shows the…

超导电性 · 物理学 2007-05-23 T. Sasaki , I. Ito , N. Yoneyama , N. Kobayashi , N. Hanasaki , H. Tajima , T. Ito , Y. Iwasa

The two-dimensional organic conductor $\alpha$-(BEDT-TTF)$_2$I$_3$ undergoes a metal-insulator transition at $T_{\rm CO}=135$ K due to electronic charge ordering. We have conducted time-resolved investigations of its electronic properties…

强关联电子 · 物理学 2016-06-15 Tobias Peterseim , Tomislav Ivek , Dieter Schweitzer , Martin Dressel

By using variational wave functions and quantum Monte Carlo techniques, we investigate the interplay between electron-electron and electron-phonon interactions in the two-dimensional Hubbard-Holstein model. Here, the ground-state phase…

强关联电子 · 物理学 2017-11-28 Seher Karakuzu , Luca F. Tocchio , Sandro Sorella , Federico Becca

Recently the ferroelectric anomaly (Nad, Monceau, et al) followed by the charge disproportionation (Brown, et al) have been discovered in (TMTTF)2X compounds. The corresponding theory of the combined Mott-Hubbard state describes both…

强关联电子 · 物理学 2009-11-10 S. Brazovskii

We examine the edge states of the Dirac electrons in the molecular material \alpha-(BEDT-TTF)2I3 with electron-electron interactions. Based on the analysis of the extended Hubbard model with the Hartree-Fock approximation, we show that the…

强关联电子 · 物理学 2013-07-19 Yukiko Omori , Genki Matsuno , Akito Kobayashi

The charge response of charge-ordered state in the organic conductor alpha-(BEDT-TTF)2I3 is characterized by dc resistivity, dielectric and optical spectroscopy in different crystallographic directions within the two-dimensional conduction…

强关联电子 · 物理学 2010-05-27 T. Ivek , B. Korin-Hamzic , O. Milat , S. Tomic , C. Clauss , N. Drichko , D. Schweitzer , M. Dressel

We present a qualitative model for a fundamental process in molecular electronics: the change in conductance upon bond breaking. In our model a diatomic molecule is attached to spin-polarized contacts. Employing a Hubbard Hamiltonian,…

材料科学 · 物理学 2008-06-24 Ali Goker , Francois Goyer , Matthias Ernzerhof

Charge dynamics in a dimer Mott insulating system, where a non-polar dimer-Mott (DM) phase and a polar charge-ordered (CO) phase compete with each other, are studied. In particular, collective charge excitations are analyzed in the three…

强关联电子 · 物理学 2015-06-11 Makoto Naka , Sumio Ishihara

The terahertz (THz) response in 10-100 cm^-1 was investigated in an organic dimer-Mott (DM) insulator kappa-(ET)_2Cu_2(CN)_3 that exhibits a relaxor-like dielectric anomaly. 30 cm^-1 band in the optical conductivity was attributable to…

强关联电子 · 物理学 2015-05-26 K. Itoh , H. Itoh , M. Naka , S. Saito , I. Hosako , N. Yoneyama , S. Ishihara , T. Sasaki , S. Iwai

A one-dimensional model of interacting electrons with on-site $U$, nearest-neighbor $V$, and correlated-hopping interaction $T^{\ast}$ is studied at half-filling using the continuum-limit field theory approach. The ground state phase…

强关联电子 · 物理学 2009-10-31 G. I. Japaridze , A. P. Kampf

By applying measurements of the dielectric constants and relative length changes to the dimerized molecular conductor $\kappa$-(BEDT-TTF)$_2$Hg(SCN)$_2$Cl, we provide evidence for order-disorder type electronic ferroelectricity which is…

Recent studies of organic molecular solids are highlighted by their complex phase diagram and light-induced phenomena, such as Mott insulator, spin liquid phase, and superconductivity. However, a discrepancy between experimental observation…

The charge-ordered insulator $\alpha$-(BEDT-TTF)$_2$I$_3$ gradually evolves to a metal when pressure is applied, and at low temperatures the electronic bands form tilted Dirac-like cones. A metallic state with a frequency-independent…

强关联电子 · 物理学 2019-05-22 Weiwu Li , Ece Uykur , Christine A. Kuntscher , Martin Dressel

Quantum simulations can provide new insights into the physics of strongly correlated electronic systems. A well studied system, but still open in many regards, is the Hubbard-Holstein Hamiltonian, where electronic repulsion is in…

强关联电子 · 物理学 2021-12-08 Utso Bhattacharya , Tobias Graß , Adrian Bachtold , Maciej Lewenstein , Fabio Pistolesi

Motivated by the results of recent transport and optical conductivity studies, we propose a semi-infinite two-dimensional lattice model for interacting massive Dirac electrons in the pressurized organic conductor…

介观与纳米尺度物理 · 物理学 2019-09-04 Daigo Ohki , Yukiko Omori , Akito Kobayashi

We study photoinduced optical responses of one-dimensional strongly correlated electron systems. The optical conductivity spectra are calculated for the ground state and a photoexcited state in the one-dimensional Hubbard model at half…

强关联电子 · 物理学 2009-11-11 Nobuya Maeshima , Kenji Yonemitsu

We determine the optical response of topological insulator thin films in the presence of a quantizing, external magnetic field. We explicitly take into account hybridization between the states of top and bottom surface. The interplay…

介观与纳米尺度物理 · 物理学 2015-06-22 A. Ullah , K. Sabeeh
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