Phase diagram of the one-dimensional extended Hubbard model at half filling

We reexamine the ground-state phase diagram of the one-dimensional half-filled Hubbard model with on-site and nearest-neighbor repulsive interactions. We calculate second-order corrections to coupling constants in the weak-coupling renormalization-group approach ( g-ology) to show that the bond-charge-density-wave (BCDW) phase exists for weak couplings in between the charge-density-wave (CDW) and spin-density-wave (SDW) phases. We find that the umklapp scattering of parallel-spin electrons destabilizes the BCDW state and gives rise to a bicritical point where the CDW-BCDW and SDW-BCDW continuous-transition lines merge into the CDW-SDW first-order transition line.     

Correlated insulated phase suggests bond order between band and mott insulators in two dimensions

We investigate the ground state phase diagram of the half-filled repulsive Hubbard model in two dimensions in the presence of a staggered potential Delta, the so-called ionic Hubbard model, using cluster dynamical mean-field theory. We find that for large Coulomb repulsion, U > Delta, the system is a Mott insulator (MI). For weak to intermediate values of Delta, on decreasing U, the Mott gap closes at a critical value Uc1(Delta) beyond which a correlated insulating phase with possible bond order is found. Further, this phase undergoes a first-order transition to a band insulator (BI) at Uc2(Delta) with a finite charge gap at the transition. For large Delta, there is a direct first-order transition from a MI to a BI with a single metallic point at the phase boundary.     

Theory for Difference Between Photoinduced Phase and Thermally Excited Phase

A possible difference between the photoinduced phase and the thermally excited one is studied by using a two-dimensional extended Peierls-Hubbard model, which includes a strong electron-phonon coupling and a on-site interelectron repulsion, as well as an anharmonic lattice potential. Because of this anharmonicity, the system undergoes a first order phase transition from an insulating CDW state to a metallic one at a high temperature. Although some sign of an SDW order is expected to appear due to this repulsion, it is always hidden in any equilibrium phase of the present system. In fact, it is hidden, not only in the CDW ground state, but also in this metallic one, since the high temperature itself destroys the SDW order, far before the CDW-metal transition occurs, while a photo-excitation at low enough temperature is shown to generate a local metastable SDW domain. Therefore, to observe the presence of such Coulomb interaction and the resultant broken symmetry, a nonequilibrium photoinduced phase is shown to be most straightforward. Thus, the photoinduce phase transition can make an interaction appear as a broken symmetry only in this phase, even though this interaction is almost completely hidden in all the equilibrium phases from low temperature to high ones.     

Mott transition of excitons in coupled quantum wells

In this work we study the phase diagram of indirect excitons in coupled quantum wells and show that the system undergoes a phase transition to an unbound electron-hole plasma. This transition is manifested as an abrupt change in the photoluminescence linewidth and peak energy at some critical power density and temperature. By measuring the exciton diamagnetism, we show that the transition is associated with an abrupt increase in the exciton radius. We find that the transition is stimulated by the presence of direct excitons in one of the wells and show that they serve as a catalyst of the transition.     

Phase diagram of a polydisperse soft-spheres model for liquids and colloids

The phase diagram of soft spheres with size dispersion is studied by means of an optimized Monte Carlo algorithm which allows us to equilibrate below the kinetic glass transition for all size distributions. The system ubiquitously undergoes a first-order freezing transition. While for a small size dispersion the frozen phase has a crystalline structure, large density inhomogeneities appear in the highly disperse systems. Studying the interplay between the equilibrium phase diagram and the kinetic glass transition, we argue that the experimentally found terminal polydispersity of colloids is a purely kinetic phenomenon.     

Hexagonal and square flux line lattices in CeCoIn5

Using small-angle neutron scattering, we have imaged the magnetic flux line lattice (FLL) in the d-wave heavy-fermion superconductor CeCoIn5. At low fields we find a hexagonal FLL. Around 0.6 T this undergoes what is most likely a first-order transition to square symmetry, with the nearest neighbors oriented along the gap node directions. This orientation of the square FLL is consistent with theoretical predictions based on the d-wave order parameter symmetry.     

Phase diagram of the one-dimensional half-filled extended Hubbard model

We determine the ground-state phase diagram of the one-dimensional half-filled Hubbard model with on-site (nearest-neighbor) repulsive interaction U (V) and nearest-neighbor hopping t using the density-matrix renormalization group technique. Based on the results of the excitation gaps, Luttinger-liquid exponents, and bond-order-wave (BOW) order parameter, we confirm that the BOW phase appears in a substantial region between the charge-density-wave (CDW) and spin-density-wave phases. Each phase boundary is determined by multiple means and it allows us to make a cross-check on the validity of our estimations. We also find that the BOW-CDW transition changes from continuous to first order at the tricritical point (U(t),V(t)) approximately (5.89 t,3.10 t) and the BOW phase shrinks to zero at the critical end point (U(c),V(c)) approximately (9.25 t,4.76 t).     

Overlayer strain relief on surfaces with square symmetry: phase diagram for a 2D Frenkel-Kontorova model

Overlayers on surfaces with square symmetry exhibit a huge variety of strain relief mechanisms. I present a simple 2D Frenkel-Kontorova model and calculate the associated zero temperature phase diagram which shows a transition from overlayers with square symmetry (and possible square dislocation patterns) to hexagonal symmetry. The phase diagram includes the experimentally observed clock-rotated phase. Local density approximation calculations suggested by the model show that a clean Ni(100) surface reconstructs from a bulk-terminated to a clock-rotated structure at biaxial compressive strains above 2.5%.     

Inhomogeneous chiral symmetry breaking phases

We investigate inhomogeneous chiral symmetry breaking phases in the phase diagram of the two-flavor Nambu-Jona-Lasinio model, concentrating on phases with one-dimensional modulations. It is found that the first-order transition line in the phase diagram of homogeneous phases gets completely covered by an inhomogeneous phase which is bordered by second-order transition lines. The inhomogeneous phase turns out to be remarkably stable when vector interactions are included.     

Ground-state phase diagram of a half-filled one-dimensional extended hubbard model

The density-matrix renormalization group is used to study the phase diagram of the one-dimensional half-filled Hubbard model with on-site (U) and nearest-neighbor (V) repulsion and hopping t. A critical line V(c)(U) approximately U/2 separates a Mott insulating phase from a charge-density-wave phase. The formation of bound charge excitations for V>2t changes the phase transition from continuous to first-order at a tricritical point U(t) approximately 3.7t, V(t)=2t. A frustrating effective antiferromagnetic spin coupling induces a bond-order-wave phase on the critical line V(c)(U) for U(t)相似文献   

From low-dimensional synchronous chaos to high-dimensional desynchronous spatiotemporal chaos in coupled systems

The dynamic behavior of coupled chaotic oscillators is investigated. For small coupling, chaotic state undergoes a transition from a spatially disordered phase to an ordered phase with an orientation symmetry breaking. For large coupling, a transition from full synchronization to partial synchronization with translation symmetry breaking is observed. Two bifurcation branches, one in-phase branch starting from synchronous chaos and the other antiphase branch bifurcated from spatially random chaos, are identified by varying coupling strength epsilon. Hysteresis, bistability, and first-order transitions between these two branches are observed.     

The effective-field theory studies of critical phenomena in a mixed spin-1 and spin-2 Ising model on honeycomb and square lattices

An effective-field theory with correlations has been used to study critical behaviors of a mixed spin-1 and spin-2 Ising system on a honeycomb and square lattices in the absence and presence of a longitudinal magnetic field. The ground-state phase diagram of the model is obtained in the longitudinal magnetic field (h) and a single-ion potential or crystal-field interaction (Δ) plane. The thermal behavior of the sublattice magnetizations of the system are investigated to characterize the nature of (continuous and discontinuous) of the phase transitions and obtain the phase transition temperature. The phase diagrams are presented in the (Δ/|J|, k_BT/|J|) plane. The susceptibility, internal energy and specific heat of the system are numerically examined and some interesting phenomena in these quantities are found due to the absence and presence of the applied longitudinal magnetic field. Moreover, the system undergoes second- and first-order phase transition; hence, the system gives a tricritical point. The system also exhibits reentrant behavior.     

Two-Dimensional Oriented Self-Avoiding Walks with Parallel Contacts

Two closely related models of oriented self-avoiding walks (OSAWs) on a square lattice are studied. We use the pruned-enriched Rosenbluth method to determine numerically the phase diagram. Both models have three phases: a tight-spiral phase in which the binding of parallel steps dominates, a collapsed phase when the binding of antiparallel steps dominates, and a free (open coil) phase. We show that the system features a first-order phase transition from the free phase to the tight-spiral phase, while both other transitions are continuous. The location of the phases is determined accurately. We also study turning numbers and gamma exponents in various regions of the phase diagram.     

二维３态Potts量子系统的保真度与序参量

二维无限正方格子上的量子3态Potts模型是发生一级相变还是二级相变?通过运用无限纠缠投影对态算法(iPEPS),在进行数值模拟时任意选取初态,能得到二维无限正方格子上的3态Potts模型的三个不同的简并基态波函数,这些简并的情况是由自发对称性破缺引起的.首先,揭示了在二维系统中自发对称性破缺引起的相变可以运用单点基态保真度的分叉来研究,也反映了在二维系统中约化保真度同样有一个分叉行为;再者,还开创性提出了二维系统的普适序参量以及多分量的复数局域序参量的行为来尝试研究二维3态Potts模型,共同确定系统发生的量子相变的临界点及其类型.即基于iPEPS算法,从单点基态保真度、约化保真度、普适序参量以及局域序参量的角度,来研究3态Potts模型的量子相变,其为一级相变.     

Thermally activated charge carriers and mid-infrared optical excitations in quarter-filled CDW systems

The optical properties of the quarter-filled single-band CDW systems have been reexamined in the model with the electron-phonon coupling related to the variations of electron site energies. It appears that the indirect, electron-mediated coupling between phase phonons and external electromagnetic fields vanishes for symmetry reasons, at variance with the infrared selection rules used in the generally accepted microscopic theory. It is shown that the phase phonon modes and the electric fields couple directly, with the coupling constant proportional to the magnitude of the charge-density wave. The single-particle contributions to the optical conductivity tensor are determined for the ordered CDW state and the related weakly doped metallic state by means of the Bethe-Salpeter equations for elementary electron-hole excitations. It turns out that this gauge-invariant approach establishes a clear connection between the effective numbers of residual, thermally activated and bound charge carriers. Finally, the relation between these numbers and the activation energy of dc conductivity and the optical CDW gap scale is explained in the way consistent with the conductivity sum rules.     

二维３态Potts量子系统的保真度与序参量

二维无限正方格子上的量子3态Potts模型是发生一级相变还是二级相变?通过运用无限纠缠投影对态 (iPEPS) 算法,在进行数值模拟时任意选取初态,能得到二维无限正方格子上的3态Potts模型的三个不同的简并基态波函数,这些简并的情况是由自发对称性破缺引起的.首先,揭示了在二维系统中自发对称性破缺引起的相变可以运用单点基态保真度的分叉来研究,也反映了在二维系统中约化保真度同样有一个分叉行为;再者,还提出了二维系统的普适序参量以及多分量的复数局域序参量的行为来尝试研究二维3态Potts模型,共同确定系统发生的量子相变的临界点及其类型.即基于iPEPS算法,从单点基态保真度、约化保真度、普适序参量以及局域序参量的角度,来研究3态Potts模型的量子相变,其为一级相变.     

二维3态Potts量子系统的保真度与序参量

二维无限正方格子上的量子3态Potts模型是发生一级相变还是二级相变?通过运用无限纠缠投影对态(i PEPS)算法,在进行数值模拟时任意选取初态,能得到二维无限正方格子上的3态Potts模型的三个不同的简并基态波函数,这些简并的情况是由自发对称性破缺引起的.首先,揭示了在二维系统中自发对称性破缺引起的相变可以运用单点基态保真度的分叉来研究,也反映了在二维系统中约化保真度同样有一个分叉行为;再者,还提出了二维系统的普适序参量以及多分量的复数局域序参量的行为来尝试研究二维3态Potts模型,共同确定系统发生的量子相变的临界点及其类型.即基于i PEPS算法,从单点基态保真度、约化保真度、普适序参量以及局域序参量的角度,来研究3态Potts模型的量子相变,其为一级相变.     

Half-filled layered organic superconductors and the resonating-valence-bond theory of the hubbard-heisenberg model

We present a resonating-valence-bond theory of superconductivity for the Hubbard-Heisenberg model on an anisotropic triangular lattice. Our calculations are consistent with the observed phase diagram of the half-filled layered organic superconductors, such as the beta, beta', kappa, and lambda phases of (BEDT-TTF)2X [bis(ethylenedithio)tetrathiafulvalene] and (BETS)2X [bis(ethylenedithio)tetraselenafulvalene]. We find a first order transition from a Mott insulator to a dx2-y2 superconductor with a small superfluid stiffness and a pseudogap with dx2-y2 symmetry.     

Spin density wave and ferromagnetism in a quasi-one-dimensional organic polymer

The spin density wave(SDW) — charge density wave(CDW) phase transition and the magnetic properties in a half-filled quasi-one-dimensional organic polymer are investigated by the world line Monte Carlo simulations. The itinerant π electrons moving along the polymer chain are coupled radically to localized unpaired d electrons, which are situated at every other site of the polymer chain. The results show that both ferromagnetic and anti-ferromagnetic radical couplings enhance the SDW phase and the ferromagnet order of the radical spins, but suppress the CDW phase. By finite size scaling, we are able to obtain the phase transition line in the parameter space. The ferromagnetic order of the radical spins are observed to coexist with the SDW phase. As compared to the system being free of the radical coupling, the phase transition line is shifted upward in the U-V parameter space in favor of larger V, where U is the on-site repulsion and V is the nearest-neighbor interaction between the π electrons. All of these findings can be understood qualitatively by a second-order perturbation theory starting from the classical state at zero temperature in the strong coupling limit. We also address the consequences of the radical coupling for the persistent current if the polymer chain is fabricated as a mesoscopic ring.