First-order Transition Line Research Articles

A quantum magnetic analogue to the critical point of water.

At the liquid-gas phase transition in water, the density has a discontinuity at atmospheric pressure; however, the line of these first-order transitions defined by increasing the applied pressure terminates at the critical point1, a concept ubiquitous in statistical thermodynamics2. In correlated quantum materials, it was predicted3 and then confirmed experimentally4,5 that a critical point terminates the line of Mott metal-insulator transitions, which are also first-order with a discontinuous charge carrier density. In quantum spin systems, continuous quantum phase transitions6 have been controlled by pressure7,8, applied magnetic field9,10 and disorder11, but discontinuous quantum phase transitions have received less attention. The geometrically frustrated quantum antiferromagnet SrCu2(BO3)2 constitutes a near-exact realization of the paradigmatic Shastry-Sutherland model12-14 and displays exotic phenomena including magnetization plateaus15, low-lying bound-state excitations16, anomalous thermodynamics17 and discontinuous quantum phase transitions18,19. Here we control both the pressure and the magnetic field applied to SrCu2(BO3)2 to provide evidence of critical-point physics in a pure spin system. We use high-precision specific-heat measurements to demonstrate that, as in water, the pressure-temperature phase diagram has a first-order transition line that separates phases with different local magnetic energy densities, and that terminates at an Ising critical point. We provide a quantitative explanation of our data using recently developed finite-temperature tensor-network methods17,20-22. These results further our understanding of first-order quantum phase transitions in quantum magnetism, with potential applications in materials where anisotropic spin interactions produce the topological properties23,24 that are useful for spintronic applications.

Phase diagram for strongly interacting matter in the presence of a magnetic field using the Polyakov–Nambu–Jona-Lasinio model with magnetic field dependent coupling strengths

We study the phase diagram for strongly interacting matter using the 't Hooft determinant extended Nambu--Jona-Lasinio model with a Polyakov loop in the light and strange quark sectors (\emph{up}, \emph{down} and \emph{strange}) focusing on the effect of a magnetic field dependence of the coupling strengths of these interactions. This dependence was obtained so as to reproduce recent lattice QCD results for the magnetic field dependence of the quarks dynamical masses. A finite magnetic field is known to induce several additional first-order phase transition lines with the respective Critical End Points (CEP) in the temperature-quark chemical potential phase diagram when compared to the zero magnetic field case. A study of the magnetic field dependence in the range $eB=0-0.6~\mathrm{GeV}^2$ of the location of these CEPs reveals that the initial one as well as several of the new ones only survive up to a critical magnetic field. Only two remain in the upper limit of the studied magnetic field strength. A comparison of the results obtained with versions of the model with and without Polyakov loop is also done. We also found that the inclusion of the magnetic field dependence on the coupling strengths, while not changing the qualitative features of the phase diagram, affects the location of these CEPs. The comparison of results with and without a regularization cutoff in the medium part of the integrals does not show a significant change.

Existence of a quadruple point in a binary ferroelectric phase diagram

In experimentally measured temperature-composition ferroelectric phase diagrams of ${\mathrm{BaTiO}}_{3}$-based binary systems, a quadruple point where cubic (C), tetragonal (T), orthorhombic (O), and rhombohedral (R) phases converge has been frequently reported in previous work. More interestingly, the quadruple points are experimentally found to behave as a critical point with large enhancement in properties. However, it has remained a fundamental question as to whether a quadruple point in a binary ferroelectric system defies the thermodynamic phase rule and whether such a point necessarily goes critical. In this study, it is demonstrated by Landau theory that a C-T-O-R quadruple point in a binary ferroelectric system can only exist in the form of a unique type of critical point at which two first-order transition lines and two second-order ones meet, and such critical quadruple points do not defy the thermodynamic phase rule. It is further shown that at such a critical C-T-O-R quadruple point, the system exhibits infinitely large piezoelectric coefficients, which agrees with the high piezoelectricity observed at the C-T-O-R quadruple point in a number of ${\mathrm{BaTiO}}_{3}$-based binary ferroelectric systems and also helps to explain the large piezoelectricity obtained at the morphotropic phase boundaries of these quadruple point based systems.

Current-induced phase transition of moving vortices in untwinned YBa2Cu3O7−δ single crystals

To study the phase transition of vortices induced by current flow, the electrical resistivity and the voltage–current characteristic have been measured on untwinned YBa2Cu3O7−δ single crystals in a magnetic field parallel to the c axis. Near a first-order melting transition (FOMT) line, the well-known counterclockwise hysteresis of resistivity drop disappears completely above a certain current density while a novel clockwise hysteresis appears just below this resistivity drop. Moreover, the voltage–current characteristic does not show any Ohmic behavior as the current increases near the FOMT line. The obtained results are explained by the current-induced melting of the vortex lattice or smectic similar to an increase in the temperature or the magnetic field.

Quantum annealed criticality: A scaling description

Experimentally there exist many materials with first-order phase transitions at finite temperature that display quantum criticality. Classically, a strain-energy density coupling is known to drive first-order transitions in compressible systems, and here we generalize this Larkin-Pikin mechanism to the quantum case. We show that if the T=0 system lies above its upper critical dimension, the line of first-order transitions ends in a "quantum annealed critical point" where zero-point fluctuations restore the underlying criticality of the order parameter. The generalized Larkin-Pikin phase diagram is presented and experimental consequences are discussed.

Multicritical Deconfined Quantum Criticality and Lifshitz Point of a Helical Valence-Bond Phase.

The S=1/2 square-lattice J-Q model hosts a deconfined quantum phase transition between antiferromagnetic and dimerized (valence-bond solid) ground states. We here study two deformations of this model-a term projecting staggered singlets, as well as a modulation of the J terms forming alternating "staircases" of strong and weak couplings. The first deformation preserves all lattice symmetries. Using quantum MonteCarlo simulations, we show that it nevertheless introduces a second relevant field, likely by producing topological defects. The second deformation induces helical valence-bond order. Thus, we identify the deconfined quantum critical point as a multicritical Lifshitz point-the end point of the helical phase and also the end point of a line of first-order transitions. The helical-antiferromagnetic transitions form a line of generic deconfined quantum-critical points. These findings extend the scope of deconfined quantum criticality and resolve a previously inconsistent critical-exponent bound from the conformal-bootstrap method.

Griffiths-like phase close to the Mott transition

We explore the coexistence region in the vicinity of the Mott critical end point employing a compressible cell spin-1/2 Ising-like model. We analyze the case for the spin-liquid candidate κ-(BEDT-TTF)2Cu2(CN)3, where close to the Mott critical end point metallic puddles coexist with an insulating ferroelectric phase. Our results are fourfold: (i) a universal divergent-like behavior of the Grüneisen parameter upon crossing the first-order transition line; (ii) based on scaling arguments, we show that within the coexistence region, for any system close to the critical point, the relaxation-time is entropy-dependent; (iii) we propose the electric Grüneisen parameter ΓE, which quantifies the electrocaloric effect; and (iv) we identify the metallic/insulating coexistence region as an electronic Griffiths-like phase. Our findings suggest that ΓE governs the dielectric response close to the critical point and that an electronic Griffiths-like phase emerges in the coexistence region.

Random-field Ising model criticality in a glass-forming liquid.

We use computer simulations to investigate the extended phase diagram of a supercooled liquid linearly coupled to a quenched reference configuration. An extensive finite-size scaling analysis demonstrates the existence of a random-field Ising model (RFIM) critical point and of a first-order transition line, in agreement with recent field-theoretical approaches. The dynamics in the vicinity of this critical point resembles the peculiar activated scaling of RFIM-like systems, and the overlap autocorrelation displays a logarithmic stretching. Our study demonstrates RFIM criticality in the thermodynamic limit for a three-dimensional supercooled liquid at equilibrium.

Phenomenological theory in reentrant uranium-based superconductors

We develop a phenomenological theory for the family of uranium-based heavy fermion superconductors ($URhGe$, $UCoGe$, and $UTe_2$ ). The theory unifies the understanding of both superconductivity(SC) with a weak magnetic field and reentrant superconductivity(RSC) that appears at the first-order transition line with a high magnetic field. It is shown that the magnetizations along the easy and hard axis have opposite effects on superconductivity. The RSC is induced by the fluctuation parallel to the direction of the magnetic field. The theory makes specific predictions about the variation of triplet superconductivity order parameters $\vec{d}$ with applied external magnetic fields and the existence of a metastable state for the appearance of the RSC.

Bridging transitions and capillary forces for colloids in a slit.

Capillary bridges can form between colloids immersed in a two-phase fluid, e.g., in a binary liquid mixture, if the surface of the colloids prefers the species other than the one favored in the bulk liquid. Here, we study the formation of liquid bridges induced by confining colloids to a slit, with the slit walls having a preference opposite to the one of the colloid surface. Using mean field theory, we show that there is a line of first-order phase transitions between the bridge and the no-bridge states, which ends at a critical point. By decreasing the slit width, this critical point is shifted toward smaller separations between the colloids. However, at very small separations and far from criticality, we observe only a minor influence of the slit width on the location of the transition. Monte Carlo simulations of the Ising model, which mimics incompressible binary liquid mixtures, confirm the occurrence of the bridging transitions, as manifested by the appearance of "spinodal" regions where both bridge and no-bridge configurations are stable or metastable. Interestingly, we find that there is no such spinodal region in the case of small colloids, but we observe a sharpening of the transition when the colloid size increases. In addition, we demonstrate that the capillary force acting between the colloids can depend sensitively on the slit width and varies drastically with temperature, thus achieving strengths orders of magnitude higher than at criticality of the fluid.

Dynamical phase transitions for the activity biased Ising model in a magnetic field

We consider large deviations of the dynamical activity—defined as the total number of configuration changes within a time interval—for mean-field and one-dimensional Ising models, in the presence of a magnetic field. We identify several dynamical phase transitions that appear as singularities in the scaled cumulant generating function of the activity. In particular, we find low-activity ferromagnetic states and a novel high-activity phase, with associated first- and second-order phase transitions. The high-activity phase has a negative susceptibility to the magnetic field. In the mean-field case, we analyse the dynamical phase coexistence that occurs on first-order transition lines, including the optimal-control forces that reproduce the relevant large deviations. In the one-dimensional model, we use exact diagonalisation and cloning methods to perform finite-size scaling of the first-order phase transition at non-zero magnetic field.

Reduction of energy-gap scaling by coherent catalysis in models of quantum annealing

Non-stoquastic drivers are known to improve the performance of quantum annealing by reducing first-order phase transitions into second-order ones in several mean-field-type model systems. Nevertheless, statistical-mechanical analysis shows that some target Hamiltonians still exhibit unavoidable first-order transitions even with non-stoquastic drivers, making them difficult for quantum annealing to solve. Recently, a mechanism called coherent catalysis was proposed by Durkin [Phys. Rev. A \textbf{99}, 032315 (2019)], in which he showed the existence of a particular point on the line of first-order phase transitions where the energy gap scales polynomially as expected for a second-order transition. We show by extensive numerical computations that this phenomenon is observed in a few additional mean-field-type optimization problems where non-stoquastic drivers fail to change the order of phase transition in the thermodynamic limit. This opens up the possibility of using coherent catalysis to search for exponential speedups in systems previously thought to be exponentially slow for quantum annealing to solve.

Vortex phase diagram of rotating superfluid He3−B

We present the first theoretical calculation of the pressure-temperature-field phase diagram for the vortex phases of rotating superfluid $^3$He-B. Based on a strong-coupling extension of the Ginzburg-Landau theory that accounts for the relative stability of the bulk A and B phases of $^3$He at all pressures, we report calculations for the internal structure and free energies of distinct broken-symmetry vortices in rotating superfluid $^3$He-B. Theoretical results for the equilibrium vortex phase diagram in zero field and an external field of $H=284\,\mbox{G}$ parallel to the rotation axis, $\vec{H}\parallel\vec{\Omega}$, are reported, as well as the supercooling transition line, $T^{*}_ {v} (p,H)$. In zero field the vortex phases of $^3$He-B are separated by a first-order phase transition line $T_ {v} (p)$ that terminates on the bulk critical line $T_{c}(p)$ at a triple point. The low-pressure, low-temperature phase is characterized by an array of singly-quantized vortices that spontaneously breaks axial rotation symmetry, exhibits anisotropic vortex currents and an axial current anomaly (D-core phase). The high-pressure, high-temperature phase is characterized by vortices with both bulk A phase and $\beta$ phase in their cores (A-core phase). We show that this phase is metastable and supercools down to a minimum temperature, $T^{*}_ {v} (p,H)$, below which it is globally unstable to an array of D-core vortices. For $H\gtrsim 60\,\mbox{G}$ external magnetic fields aligned along the axis of rotation increase the region of stability of the A-core phase of rotating $^3$He-B, opening a window of stability down to low pressures. These results are compared with the experimentally reported phase transitions in rotating $^3$He-B.

Locating fixed points in the phase plane.

The critical point is a fixed point in finite-size scaling. To quantify the behavior of such a fixed point, we define, at a given temperature and scaling exponent ratio, the width of scaled observables for different sizes. The minimum of the width reveals the position of the fixed point, its corresponding phase transition temperature, and scaling exponent ratio. The value of this ratio tells the nature of the fixed point, which can be a critical point, a point of the first-order phase transition line, or a point of the crossover region. To demonstrate the effectiveness of this method, we apply it to three typical samples produced by the three-dimensional three-state Potts model. Results show the method to be more precise and effective than conventional methods. Finally, we discuss a possible application at the Beam Energy Scan program of the Relativistic Heavy Ion Collider.

Thermal tensor network simulations of the Heisenberg model on the Bethe lattice

We have extended the canonical tree tensor network (TTN) method, which was initially introduced to simulate the zero-temperature properties of quantum lattice models on the Bethe lattice, to finite temperature simulations. By representing the thermal density matrix with a canonicalized tree tensor product operator, we optimize the TTN and accurately evaluate the thermodynamic quantities, including the internal energy, specific heat, and the spontaneous magnetization, etc, at various temperatures. By varying the anisotropic coupling constant $\Delta$, we obtain the phase diagram of the spin-1/2 Heisenberg XXZ model on the Bethe lattice, where three kinds of magnetic ordered phases, namely the ferromagnetic, XY and antiferromagnetic ordered phases, are found in low temperatures and separated from the high-$T$ paramagnetic phase by a continuous thermal phase transition at $T_c$. The XY phase is separated from the other two phases by two first-order phase transition lines at the symmetric coupling points $ \Delta=\pm 1$. We have also carried out a linear spin wave calculation on the Bethe lattice, showing that the low-energy magnetic excitations are always gapped, and find the obtained magnon gaps in very good agreement with those estimated from the TTN simulations. Despite the gapped excitation spectrum, Goldstone-like transverse fluctuation modes, as a manifestation of spontaneous continuous symmetry breaking, are observed in the ordered magnetic phases with $|\Delta|\le 1$. One remarkable feature there is that the prominent transverse correlation length reaches $\xi_c=1/\ln{(z-1)}$ for $T\leq T_c$, the maximal value allowed on a $z$-coordinated Bethe lattice.

Phases of melonic quantum mechanics

We explore in detail the properties of two melonic quantum mechanical theories which can be formulated either as fermionic matrix quantum mechanics in the new large $D$ limit, or as disordered models. Both models have a mass parameter $m$ and the transition from the perturbative large $m$ region to the strongly coupled "black-hole" small $m$ region is associated with several interesting phenomena. One model, with ${\rm U}(n)^2$ symmetry and equivalent to complex SYK, has a line of first-order phase transitions terminating, for a strictly positive temperature, at a critical point having non-trivial, non-mean-field critical exponents for standard thermodynamical quantities. Quasi-normal frequencies, as well as Lyapunov exponents associated with out-of-time-ordered four-point functions, are also singular at the critical point, leading to interesting new critical exponents. The other model, with reduced ${\rm U}(n)$ symmetry, has a quantum critical point at strictly zero temperature and positive critical mass $m_*$. For $0<m<m_*$, it flows to a new gapless IR fixed point, for which the standard scale invariance is spontaneously broken by the appearance of distinct scaling dimensions $\Delta_+$ and $\Delta_-$ for the Euclidean two-point function when $t\rightarrow +\infty$ and $t\rightarrow -\infty$ respectively. We provide several detailed and pedagogical derivations, including rigorous proofs or simplified arguments for some results that were already known in the literature.

Thermodynamics of supercooled and stretched water: Unifying two-structure description and liquid-vapor spinodal

We have applied a two-structure approach to the description of the thermodynamic properties of supercooled and stretched water, metastable toward vapor, ice, or both, by incorporating the stability limit of liquid with respect to vapor at negative pressures. In addition to the properties of water considered in previous studies, we include new data recently obtained in deeply supercooled and stretched regions. Our model reproduces the experimentally observed anomalies in metastable water up to 400 MPa and down to -140 MPa, and can provide a physically based extrapolation in regions where no measurements are available yet. Moreover, we are able to elucidate the thermodynamic nature of the alternative "states" of liquid water, namely, high-temperature denser water (state A) and "mother-of-ice" lighter water (state B). Based on the internal consistency of the described anomalies and new data on the isothermal compressibility, we exclude the critical-point-free scenario in which the first-order liquid-liquid transition line would continue into the stretched liquid state (doubly metastable) crossing the vapor-liquid spinodal. A "singularity-free" scenario remains an option for explaining supercooled water's anomalies within the framework of two-state thermodynamics; however, the extreme case of the singularity-free scenario, ideal mixing of A and B, seems improbable. We have also clarified the concept of fast interconversion of alternative states in supercooled water as a phenomenological representation of distribution of short-ranged local structures.

Fluctuations in cool quark matter and the phase diagram of quantum chromodynamics

We consider the phase diagram of hadronic matter as a function of temperature, T , and baryon chemical potential, mu. Currently the dominant paradigm is a line of first order transitions which ends at a critical endpoint. In this work we suggest that spatially inhomogenous phases are a generic feature of the hadronic phase diagram at nonzero mu and low T . Familiar examples are pion and kaon condensates. At higher densities, we argue that these condensates connect onto chiral spirals in a quarkyonic regime. Both of these phases exhibit the spontaneous breaking of a global U(1) symmetry and quasi-long range order, analogous to smectic liquid crystals. We argue that there is a continuous line of first order transitions which separate spatially inhomogenous from homogenous phases, where the latter can be either a hadronic phase or a quark-gluon plasma. While mean field theory predicts that there is a Lifshitz point along this line of first order transitions, in three spatial dimensions strong infrared fluctuations wash out any Lifshitz point. Using known results from inhomogenous polymers, we suggest that instead there is a Lifshitz regime. Non-perturbative effects are large in this regime, where the momentum dependent terms for the propagators of pions and associated modes are dominated not by terms quadratic in momenta, but quartic. Fluctuations in a Lifshitz regime may be directly relevant to the collisions of heavy ions at (relatively) low energies, sqrt(s)/A : 1 to 20 GeV.

First-order topological quantum phase transition in a strongly correlated ladder

We report on the discovery of a quantum tri-critical point (QTP) separating a line of first-order topological quantum phase transitions from a continuous transition regime in a strongly correlated one-dimensional lattice system. Specifically, we study a fermionic four-leg ladder supporting a symmetry-protected topological phase in the presence of on-site interaction, which is driven towards a trivial gapped phase by a nearest-neighbor interaction. Based on DMRG simulations, we show that, as a function of the interaction strength, the phase transition between the topological and the trivial phase switches from being continuous to exhibiting a first-order character. Remarkably, the QTP as well as the first-order character of the topological transition in the strongly correlated regime are found to clearly manifest in simple local observables.

Magnetic phase separation in a frustrated ferrimagnetic chain under a magnetic field

We use density matrix renormalization group to study the first-order quantum phase transition induced by a magnetic field $h$ in a frustrated ferrimagnetic chain. The magnetization ($m$) curve as a function of $h$ presents a macroscopic jump and the energy curve as a function of $m$ has two global minima. We characterize the two competing phases and study the phase-separated states in the coexistence region. Also, we observe that the transition is accompanied by an increase in the number of itinerant singlet pairs between sites in the unit cells of the chain. Finally, we identify the critical point at the end of the first-order transition line and a crossover line.