Symmetry Breaking in Dynamical Encounters in the Disks of Active Galactic Nuclei

The disks of active galactic nuclei (AGNs) may be important sites of binary black hole (BBH) mergers. Here we show via numerical experiments with the high-accuracy, high-precision code SpaceHub that broken symmetry in dynamical encounters in AGN disks can lead to asymmetry between prograde and retrograde BBH mergers. The direction of the hardening asymmetry depends on the initial binary semimajor axis. Under the assumption that the spin of the BHs becomes aligned with the angular momentum of the disk on a short timescale compared with the encounter timescale, an asymmetric distribution of mass-weighted projected spin χ eff is predicted in LIGO–Virgo detections of BBH mergers from AGN disks. In particular, this model predicts that positive χ eff BBH mergers are most likely for encounters with massive tertiaries in migration traps at radial distances ≳500–600 gravitational radii.

Spontaneously Broken Symmetries

The phenomenon of spontaneous symmetry breaking is a common feature of phase transitions in both classical and quantum physics. In a first part we study this phenomenon for the case of a global internal symmetry and give a simple proof of Goldstone’s theorem. We show that a massless excitation appears, corresponding to every generator of a spontaneously broken symmetry. In a second part we extend these ideas to the case of gauge symmetries and derive the Brout–Englert–Higgs mechanism. We show that the gauge boson associated with the spontaneously broken generator acquires a mass and the corresponding field, which would have been the Goldstone boson, decouples and disappears. Its degree of freedom is used to allow the transition from a massless to a massive vector field.

Cochain level May–Steenrod operations

Steenrod defined in 1947 the Steenrod squares on the mod 2 cohomology of spaces using explicit cochain formulae for the cup-i products; a family of coherent homotopies derived from the broken symmetry of Alexander–Whitney’s chain approximation to the diagonal. He later defined his homonymous operations for all primes using the homology of symmetric groups. This approach enhanced the conceptual understanding of the operations and allowed for many advances, but lacked the concreteness of their definition at the even prime. In recent years, thanks to the development of new applications of cohomology, having definitions of Steenrod operations that can be effectively computed in specific examples has become a key issue. Using the operadic viewpoint of May, this article provides such definitions at all primes introducing multioperations that generalize the Steenrod cup-i products on the simplicial and cubical cochains of spaces.

Magnetic exchange coupling in Cu dimers studied with modern multireference methods and broken-symmetry coupled cluster theory

Spin-state energetics of exchange-coupled copper complexes pose a persistent challenge for applied quantum chemistry. Here, we provide a comprehensive comparison of all available theoretical approaches to the problem of exchange coupling in two antiferromagnetically coupled bis-μ-hydroxo Cu(II) dimers. The evaluated methods include multireference methods based on the density matrix renormalization group (DMRG), multireference methods that incorporate dynamic electron correlation either perturbatively, such as the N-electron valence state perturbation theory, or variationally, such as the difference-dedicated configuration interaction. In addition, we contrast the multireference results with those obtained using broken-symmetry approaches that utilize either density functional theory or, as demonstrated here for the first time in such systems, a local implementation of coupled cluster theory. The results show that the spin-state energetics of these copper dimers are dominated by dynamic electron correlation and represent an impossible challenge for multireference methods that rely on brute-force expansion of the active space to recover correlation energy. Therefore, DMRG-based methods even at the limit of their applicability cannot describe quantitatively the antiferromagnetic exchange coupling in these dimers, in contrast to dinuclear complexes of earlier transition metal ions. The convergence of the broken-symmetry coupled cluster approach is studied and shown to be a limiting factor for the practical application of the method. The advantages and disadvantages of all approaches are discussed, and recommendations are made for future developments.