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Yuichi Otsuka

Publications and source records attributed to Yuichi Otsuka.

23 records · Page 2Linked to original sources

Finite-Temperature Properties across the Charge Ordering Transition -- Combined Bosonization, Renormalization Group, and Numerical Methods

We theoretically describe the charge ordering (CO) metal-insulator transition based on a quasi-one-dimensional extended Hubbard model, and investigate the finite temperature ($T$) properties across the transition temperature, $T_{\rm CO}$. In order to calculate $T$ dependence of physical quantities such as the spin susceptibility and the electrical resistivity, both above and below $T_{\rm CO}$, a theoretical scheme is developed which combines analytical methods with numerical calculations. We take advantage of the renormalization group equations derived from the effective bosonized Hamiltonian, where Lanczos exact diagonalization data are chosen as initial parameters, while the CO order parameter at finite-$T$ is determined by quantum Monte Carlo simulations. The results show that the spin susceptibility does not show a steep singularity at $T_{\rm CO}$, and it slightly increases compared to the case without CO because of the suppression of the spin velocity. In contrast, the resistivity exhibits a sudden increase at $T_{\rm CO}$, below which a characteristic $T$ dependence is observed. We also compare our results with experiments on molecular conductors as well as transition metal oxides showing CO.

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Phase competitions and coexistences in quasi-one-dimensional molecular conductors: exact diagonalization study

We investigate ground state properties of a quasi-one-dimensional electron-lattice coupled model for quarter-filled molecular conductors. The effective one-dimensional extended Hubbard model coupled to adiabatic lattice degree of freedom is derived by the inter-chain mean-field approximation and solved by Lanczos exact diagonalization method. We find that the critical behavior among lattice tetramerized states with different charge-lattice ordered patterns is sensitively affected by the inter-chain Coulomb interaction, lattice anharmonicity, and intrinsic dimerization. This indicates a subtle balance between these states originating from strong correlation and reduced dimensionality.

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Quantum phase transitions of the asymmetric three-leg spin tube

We investigate quantum phase transitions of the S=1/2 three-leg antiferromagnetic spin tube with asymmetric inter-chain (rung) exchange interactions. On the basis of the electron tube system, we propose a useful effective theory to give the global phase diagram of the asymmetric spin tube. In addition, using other effective theories we raise the reliability of the phase diagram. The density-matrix renormalization-group and the numerical diagonalization analyses show that the finite spin gap appears in a narrow region around the rung-symmetric line, in contrast to a recent paper by Nishimoto and Arikawa [Phys. Rev. B78, 054421 (2008)]. The numerical calculations indicate that this global phase diagram obtained by use of the effective theories is qualitatively correct. In the gapless phase on the phase diagram, the numerical data are fitted by a finite-size scaling in the c=1 conformal field theory. We argue that all the phase transitions between the gapful and gapless phases belong to the Berezinskii-Kosterlitz-Thouless universality class.

cond-mat.str-el↗

Finite-Temperature Phase Diagram of Quasi-One-Dimensional Molecular Conductors: Quantum Monte Carlo Study

Finite-temperature phase transitions in quasi-one-dimensional quarter-filled systems are investigated by the extended Hubbard model with electron-lattice coupling. Using a quantum Monte Carlo method combined with the inter-chain mean-field approximation, we clarify competing and coexisting behaviors among charge ordering, dimer Mott, and spin-Peierls states. It is pointed out that an anharmonicity of lattice distortions plays an important role in multi-critical behaviors. The results are compared with experimental data for quasi-one-dimensional molecular conductors such as DCNQI and TMTTF compounds.

cond-mat.str-el↗

First-Principles Computation of YVO3; Combining Path-Integral Renormalization Group with Density-Functional Approach

We investigate the electronic structure of the transition-metal oxide YVO3 by a hybrid first-principles scheme. The density-functional theory with the local-density-approximation by using the local muffin-tin orbital basis is applied to derive the whole band structure. The electron degrees of freedom far from the Fermi level are eliminated by a downfolding procedure leaving only the V 3d t2g Wannier band as the low-energy degrees of freedom, for which a low-energy effective model is constructed. This low-energy effective Hamiltonian is solved exactly by the path-integral renormalization group method. It is shown that the ground state has the G-type spin and the C-type orbital ordering in agreement with experimental indications. The indirect charge gap is estimated to be around 0.7 eV, which prominently improves the previous estimates by other conventional methods.

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