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Symmetry-Broken Perturbation Theory to Large Orders in Antiferromagnetic Phases

Renaud Garioud, Fedor Šimkovic, Riccardo Rossi, Gabriele La Spada, Thomas Schäfer, Félix Werner, Michel Ferrero

2024Physical Review Letters11 citationsDOI

Abstract

We introduce a spin-symmetry-broken extension of the connected determinant algorithm [Riccardo Rossi, Determinant diagrammatic Monte Carlo algorithm in the thermodynamic limit, Phys. Rev. Lett. 119, 045701 (2017).PRLTAO0031-900710.1103/PhysRevLett.119.045701]. The resulting systematic perturbative expansions around an antiferromagnetic state allow for numerically exact calculations directly inside a magnetically ordered phase. We show new precise results for the magnetic phase diagram and thermodynamics of the three-dimensional cubic Hubbard model at half-filling. With detailed computations of the order parameter in the low to intermediate-coupling regime, we establish the Néel phase boundary. The critical behavior in its vicinity is shown to be compatible with the O(3) Heisenberg universality class. By determining the evolution of the entropy with decreasing temperature through the phase transition we identify the different physical regimes at U/t=4. We provide quantitative results for several thermodynamic quantities deep inside the antiferromagnetic dome up to large interaction strengths and investigate the crossover between the Slater and Heisenberg regimes.

Topics & Concepts

PhysicsAntiferromagnetismThermodynamic limitHeisenberg modelPhase diagramCondensed matter physicsRenormalization groupFrustrationPhase transitionMonte Carlo methodCrossoverStatistical physicsQuantum mechanicsPhase (matter)Artificial intelligenceStatisticsMathematicsComputer scienceTheoretical and Computational PhysicsPhysics of Superconductivity and MagnetismQuantum many-body systems