arXiv subjects

Hiroaki Onishi

Publications and source records attributed to Hiroaki Onishi.

34 records · Page 2Linked to original sources

arXiv2007

Deformation of SU(4) singlet spin-orbital state due to Hund's rule coupling

We investigate the ground-state property and the excitation gap of a one-dimensional spin-orbital model with isotropic spin and anisotropic orbital exchange interactions, which represents the strong-coupling limit of a two-orbital Hubbard model including the Hund's rule coupling ($J$) at quarter filling, by using a density-matrix renormalization group method. At J=0, spin and orbital correlations coincide with each other with a peak at $q=π/2$, corresponding to the SU(4) singlet state. On the other hand, spin and orbital states change in a different way due to the Hund's rule coupling. With increasing $J$, the peak position of orbital correlation changes to $q=π$, while that of spin correlation remains at $q=π/2$. In addition, orbital dimer correlation becomes robust in comparison with spin dimer correlation, suggesting that quantum orbital fluctuation is enhanced by the Hund's rule coupling. Accordingly, a relatively large orbital gap opens in comparison with a spin gap, and the system is described by an effective spin system on the background of the orbital dimer state.

cond-mat.str-el↗

arXiv2006

Spin-orbital gap of multiorbital antiferromagnet

In order to discuss the spin-gap formation in a multiorbital system, we analyze an e_g-orbital Hubbard model on a geometrically frustrated zigzag chain by using a density-matrix renormalization group method. Due to the appearance of a ferro-orbital arrangement, the system is regarded as a one-orbital system, while the degree of spin frustration is controlled by the spatial anisotropy of the orbital. In the region of strong spin frustration, we observe a finite energy gap between ground and first-excited states, which should be called a spin-orbital gap. The physical meaning is clarified by an effective Heisenberg spin model including correctly the effect of the orbital arrangement influenced by the spin excitation.

cond-mat.str-el↗

arXiv2006

Effect of Hund's rule coupling on SU(4) spin-orbital system

We investigate the ground-state property of a one-dimensional two-orbital Hubbard model at quarter filling by numerical techniques such as the density-matrix renormalization group method and the exact diagonalization. When the Hund's rule coupling $J$ is zero, the model is SU(4) symmetric. In fact, both spin and orbital correlations have a peak at $q=π/2$, indicating an SU(4) singlet state with a four-site periodicity. On the other hand, with increasing $J$, it is found that the peak position of the orbital correlation changes to $q=π$, while that of the spin correlation remains at $q=π/2$. We briefly discuss how the SU(4) symmetry is broken by $J$.

cond-mat.str-el↗

arXiv2005

Multipole correlations in low-dimensional f-electron systems

By using a density matrix renormalization group method, we investigate the ground-state properties of a one-dimensional three-orbital Hubbard model on the basis of a j-j coupling scheme. For $B_4^0 \ne 0$, where $B_4^0$ is a parameter to control cubic crystalline electric field effect, one orbital is itinerant, while other two are localized. Due to the competition between itinerant and localized natures, we obtain orbital ordering pattern which is sensitive to $B_4^0$, leading to a characteristic change of $Γ_{3g}$ quadrupole state into an incommensurate structure. At $B_4^0 = 0$, all the three orbitals are degenerate, but we observe a peak at $q = 0$ in $Γ_{3g}$ quadrupole correlation, indicating a ferro-orbital state, and the peak at $q = π$ in $Γ_{4u}$ dipole correlation, suggesting an antiferromagnetic state. We also discuss the effect of $Γ_{4u}$ octupole on magnetic anisotropy.

cond-mat.str-el↗

arXiv2005

Stripe Charge Ordering in Triangular-Lattice Systems

We investigate the ground-state properties of a t2g-orbital Hubbard model on a triangular lattice at electron density 5.5 by using numerical techniques. There appear several types of paramagnetic phases, but we observe in common that one or two orbitals among three orbitals become relevant due to the effect of orbital arrangement. It is found that charge stripes stabilized by the nearest-neighbor Coulomb interaction consist of antiferromagnetic/ferro-orbital chains for small Hund's coupling, while there occurs stripe charge ordering with ferromagnetic/antiferro-orbital chains for large Hund's coupling.

cond-mat.str-el↗

arXiv2005

Spin, charge, and orbital correlations in the one-dimensional t2g-orbital Hubbard model

We present the zero-temperature phase diagram of the one-dimensional t2g-orbital Hubbard model, obtained using the density-matrix renormalization group and Lanczos techniques. Emphasis is given to the case for the electron density n=5 corresponding to five electrons per site, of relevance for some Co-based compounds. However, several other cases for electron densities between n=3 and 6 are also studied. At n=5, our results indicate a first-order transition between a paramagnetic (PM) insulator phase and a fully-polarized ferromagnetic (FM) state by tuning the Hund's coupling. The results also suggest a transition from the n=5 PM insulator phase to a metallic regime by changing the electron density, either via hole or electron doping. The behavior of the spin, charge, and orbital correlation functions in the FM and PM states are also described in the text and discussed. The robustness of these two states varying parameters suggests that they may be of relevance in more realistic higher dimensional systems as well.

cond-mat.str-el↗

arXiv2005

Spin-charge-orbital ordering on triangle-based lattices

We investigate the ground-state property of an e_g-orbital Hubbard model at quarter filling on a zigzag chain by exploiting the density matrix renormalization group method. When two orbitals are degenerate, the zigzag chain is decoupled to a doble-chain spin system to suppress the spin frustration due to the spatial anisotropy of the occupied orbital. On the other hand, when the level splitting is increased and the orbital anisotropy disappears, a characteristic change in the spin incommnsurability is observed due to the revival of the spin frustration.

cond-mat.str-el↗

arXiv2004

Orbital-based Scenario for Magnetic Structure of Neptunium Compounds

In order to understand a crucial role of orbital degree of freedom in the magnetic structure of recently synthesized neptunium compounds NpTGa_5 (T=Fe, Co, and Ni), we propose to discuss the magnetic phase of an effective two-orbital model, which has been constructed based on a j-j coupling scheme to explain the magnetic structure of uranium compounds UTGa_5. By analyzing the model with the use of numerical technique such as exact diagonalization, we obtain the phase diagram including several kinds of magnetic states. An orbital-based scenario is discussed to understand the change in the magnetic structure among C-, A-, and G-type antiferromagnetic phases, experimentally observed in NpFeGa_5, NpCoGa_5, and NpNiGa_5.

cond-mat.str-el↗

arXiv2004

Suppression of Spin Frustration due to Orbital Selection

In order to clarify a crucial role of orbital degree of freedom in geometrically frustrated systems, we investigate both ground- and excited-state properties of the e_g-orbital degenerate Hubbard model on two kinds of lattices, ladder and zigzag chain, by using numerical techniques. In the ladder, spin correlation extends on the whole system, while the zigzag chain is decoupled to a double chain and spin excitation is confined in one side of the double chain due to the selection of a specific orbital. We envision a kind of self-organization phenomenon that the geometrically frustrated multi-orbital system is spontaneously reduced to a one-orbital model to suppress the spin frustration.

cond-mat.str-el↗

arXiv2004

Orbital-controlled magnetic transition between gapful and gapless phases in the Haldane system with t2g-orbital degeneracy

In order to clarify a key role of orbital degree of freedom in the spin S=1 Haldane system, we investigate ground-state properties of the t2g-orbital degenerate Hubbard model on the linear chain by using numerical techniques. Increasing the Hund's rule coupling in multi-orbital systems, in general, there occurs a transition from an antiferromagnetic to a ferromagnetic phase. We find that the antiferromagnetic phase is described as the Haldane system with spin gap, while in the ferromagnetic phase, there exists the gapless excitation with respect to orbital degree of freedom. Possible relevance of the present results to actual systems is also discussed.

cond-mat.str-el↗

arXiv2004

Key Role of Orbital Anisotropy in Geometrically Frustrated Electron System

By using the density matrix renormalization group method, we investigate ground- and excited-state properties of the e_g-orbital degenerate Hubbard model at quarter filling for two kinds of lattices, zigzag chain and ladder. In the zigzag chain, the system is effectively regarded as a decoupled double chain of the S=1/2 antiferromagnetic Heisenberg model, and the spin gap is approximately zero, similar to the case of weakly coupled Heisenberg chains. On the other hand, in the ladder, the spin correlation on the rung remains robust and the spin gap exists.

cond-mat.str-el↗

arXiv2003

Quantum Narrowing Effect in a Spin-Peierls System with Quantum Lattice Fluctuation

We investigate a one-dimensional S=1/2 antiferromagnetic Heisenberg model coupled to quantum lattice vibration using a quantum Monte Carlo method. We study the ground-state lattice fluctuation where the system shows a characteristic structure factor. We also study the mass dependence of magnetic properties such as the magnetic susceptibility and the magnetic excitation spectrum. For heavy mass, the system shows the same behavior as the case of classical lattice vibration. On the other hand, for light mass, magnetic properties coincide with those of the static uniform chain. We investigate the physical mechanism of this behavior and propose the picture of quantum narrowing.

cond-mat.stat-mech↗

arXiv2001

Spin-Peierls transition of the first order in S=1 antiferromagnetic Heisenberg chains

We investigate a one-dimensional S=1 antiferromagnetic Heisenberg model coupled to a lattice distortion by a quantum Monte Carlo method. Investigating the ground state energy of the static bond-alternating chain, we find that the instability to a dimerized chain depends on the value of the spin-phonon coupling, unlike the case of S=1/2. The spin state is the dimer state or the uniform Haldane state depending on whether the lattice distorts or not, respectively. At an intermediate value of the spin-phonon coupling, we find the first-order transition between the two states. We also find the coexistence of the two states.

cond-mat.stat-mech↗

arXiv2000

Temperature Dependence of Spin and Bond Ordering in a Spin-Peierls System

We investigate thermodynamic properties of a one-dimensional S=1/2 antiferromagnetic Heisenberg model coupled to a lattice distortion by a quantum Monte Carlo method. In particular we study how spin and lattice dimerize as a function of the temperature, which gives a fundamental process of the spin-Peierls transition in higher dimensions. The degree of freedom of the lattice is taken into account adiabatically and the thermal distribution of the lattice distortion is obtained by the thermal bath algorithm. We find that the dimerization develops as the temperature decreases and it converges to the value of the dimerization of the ground state at T=0. Furthermore we find that the coupling constants of spins fluctuate quite largly at high temperature and there thermodynamic properties deviate from those of the uniform chain. Doping of non-magnetic impurities causes cut of the chain into short chains with open boundary. We investigate thermodynamic properties of open chains taking relaxation of the lattice into consideration. We find that strong bonds locate at the edges and a defect of the bond alternation appears in the chain with odd number of sites, which causes enhancement of the staggered magnetic order. We find a spreaded staggered structure which indicates that the defect moves diffusively in the chain even at very low temperature.

cond-mat.stat-mech↗

arXiv1999

Quantum Monte Carlo Study on Magnetization Processes

A quantum Monte Carlo method combining update of the loop algorithm with the global flip of the world line is proposed as an efficient method to study the magnetization process in an external field, which has been difficult because of inefficiency of the update of the total magnetization. The method is demonstrated in the one dimensional antiferromagnetic Heisenberg model and the trimer model. We attempted various other Monte Carlo algorithms to study systems in the external field and compared their efficiency.

cond-mat.stat-mech↗

arXiv1999

Local magnetic structure due to inhomogeneity of interaction in S=1/2 antiferromagnetic chain

We study the magnetic properties of $S=1/2$ antiferromagnetic Heisenberg chains with inhomogeneity of interaction. Using a quantum Monte Carlo method and an exact diagonalization method, we study bond-impurity effect in the uniform $S=1/2$ chain and also in the bond-alternating chain. Here `bond impurity' means a bond with strength different from those in the bulk or a defect in the alternating order. Local magnetic structures induced by bond impurities are investigated both in the ground state and at finite temperatures, calculating the local magnetization, the local susceptibility and the local field susceptibility. We also investigate the force acting between bond impurities and find the force generally attractive.

cond-mat.stat-mech↗