Gauge Dependence Research Articles

Deformable bodies in two dimensions and the gauge aspect of bottle flip

Abstract The water-bottle flip demonstration, that has received quite a viewership on media, involves tossing a bottle filled (up
to some fraction of its volume) with water up in the air while giving it a transverse spin in such a way that it lands
perfectly upright on its base. A mathematical description of the actual dynamics of the bottle flip is bound to be very
complicated due to the highly non-linear motion of the fluid. A model that is amenable to an analytical treatment has
been proposed in the literature. Conservation of angular momentum in the center of mass frame allows the angular
velocity of the bottle to change, and in particular it becomes very low right before the landing. This is thought to
be the essential feature needed for an upright landing of the bottle. In this paper we study a mathematical formalism
that would be useful to improve upon the analysis of this model. We point out that the proper mathematical setting to
analyze such systems is to model the content of the bottle as a deformable body. This brings out the gauge dependence
of the angular velocity and shows that it can even go to zero without violating the conservation of angular momentum.
The mechanism is well studied in literature under the heading of the falling cat problem. Indeed, from our point of
view the bottle-flip system is a two dimensional analog of the falling cat problem (modulo the self-control of the cat)

BRST covariant phase space and holographic Ward identities

This paper develops an enlarged BRST framework to treat the large gauge transformations of a given quantum field theory. It determines the associated infinitely many Noether charges stemming from a gauge fixed and BRST invariant Lagrangian, a result that cannot be obtained from Noether’s second theorem. The geometrical significance of this result is highlighted by the construction of a trigraded BRST covariant phase space, allowing a BRST invariant gauge fixing procedure. This provides an appropriate framework for determining the conserved BRST Noether current of the global BRST symmetry and the associated global Noether charges. The latter are found to be equivalent with the usual classical corner charges of large gauge transformations. It allows one to prove the gauge independence of their physical effects at the perturbative quantum level. In particular, the underlying BRST fundamental canonical relation provides the same graded symplectic brackets as in the classical covariant phase space. A unified Lagrangian Ward identity for small and large gauge transformations is built. It consistently decouples into a bulk part for small gauge transformations, which is the standard BRST-BV quantum master equation, and a boundary part for large gauge transformations. The boundary part provides a perturbation theory origin for the invariance of the Hamiltonian physical -matrix under asymptotic symmetries. Holographic anomalies for the boundary Ward identity are studied and found to be solutions of a codimension one Wess-Zumino consistency condition. Such solutions are studied in the context of extended BMS symmetry. Their existence clarifies the status of the 1-loop correction to the subleading soft graviton theorem.

Pulsar timing array harmonic analysis and source angular correlations

Gravitational waves (GWs) influence the arrival times of radio signals coming from pulsars. Here, we investigate the harmonic space approach to describing a pulsar’s response to GWs. We derive and discuss the “diagonalized form” of the response, which is a sum of spin-2-weighted spherical harmonics of the GW direction multiplied by normal (spin-weight 0) spherical harmonics of the pulsar direction. We show how this allows many useful objects, for example, the Hellings and Downs two-point function, to be easily calculated. The approach also provides a clear description of the gauge dependence. We then employ this harmonic approach to model the effects of angular correlations in the sky locations of GW sources (sometimes called “statistical isotropy”). To do this, we construct ensembles made up of many Gaussian subensembles. While each of the individual subsensembles breaks rotational invariance, the full ensemble is rotationally invariant. Using harmonic techniques, we compute the cosmic covariance and the total covariance of the Hellings and Downs correlation in these models. The results may be used to assess the impact of angular source correlations on the Hellings and Downs correlation, and for optimal reconstruction of the Hellings and Downs curve in models where GW sources have correlated sky locations. Published by the American Physical Society 2024

Absorption Intensities of Organic Molecules from Electronic Structure Calculations versus Experiments: the Effect of Solvation, Method, Basis Set, and Transition Moment Gauge.

Recently, we derived experimental oscillator strengths (OSs) from well-defined UV-visible absorption spectral peaks of 100 molecules in solution. Here, we focus on a subset of transitions with the highest reliability to further benchmark the OSs from several wave function methods and density functionals. We consider multiple basis sets, transition moment gauges (length, velocity, and mixed), and solvent corrections. Most transitions in the comparison set come from conjugated molecules and have π → π* character. We use an automated algorithm to assign computed transitions to experimental bands. OSs computed using the Tamm-Dancoff approximation (TDA), CIS, or EOM-CCSD exhibited a strong gauge dependence, which is diminished in linear response theories (TD-DFT, TD-HF, and to a smaller degree LR-CCSD). OSs calculated from TD-DFT with PCM solvent models are systematically larger than apparent OSs derived from experimental spectra. For example, fcomp from hybrid functionals and PCM have mean absolute errors that are ∼10% of n·fexp, where n is a solvent refractive index factor that arises from the energy flux of the radiation field in a dielectric (solvent). Theoretical cavity field corrections considering spherical cavities do not improve the agreement between computed and experimental data. Corrections that account for the molecular shape and the direction of transition dipole moments, or that explicitly account for the effect of solvent molecules on the local field, should be more appropriate.

Quantum walks in weak stochastic gauge fields

Contrary to the ballistic dynamics of standard quantum walks, the behavior of stochastic quantum walks is known to be diffusive. Here we study discrete time quantum walks in weak stochastic gauge fields. In the case of position and spin dependent gauge field, we observe a transition from ballistic to diffusive motion, with the probability distribution becoming Gaussian. However, in contradiction to common belief, weak stochastic electric gauge fields reveal the persistence of Bloch oscillations despite decoherence which we demonstrate on simulations and prove analytically. The proposed models provide insights into the interplay between randomness and coherent dynamics of quantum walks.

Gauge independent logarithms from inflationary gravitons

Dependence on the graviton gauge enters the conventional effective field equations because they fail to account for quantum gravitational correlations with the source which excites the effective field and with the observer who measures it. Including these correlations has been shown to eliminate gauge dependence in flat space background. We generalize the technique to de Sitter background for the case of the 1-loop graviton corrections to the exchange potential of a massless, minimally coupled scalar.

Teukolsky-like equations with various spins in spherically symmetric spacetime* *Supported in part by the National Natural Science Foundation of China (11973025)

We study wave equations with various spins on the background of a general spherically symmetric spacetime. We obtain the unified expression of the Teukolsky-like master equations and the corresponding radial equations with the general spins. We also discuss the gauge dependence in the gravitational-wave equations, which have appeared in previous studies.

The effective potential in Fermi gauges beyond the standard model

We derive the field-dependent masses in Fermi gauges for arbitrary scalar extensions of the Standard Model. These masses can be used to construct the effective potential for various models of new physics. We release a flexible Mathematica notebook (VefFermi) which performs these calculations and renders large-scale phenomenological studies of various models possible. Motivated by the debate on the importance of gauge dependence, we show that, even in relatively simple models, there exist points where the global minimum is discontinuous in the gauge parameter. Such points require some care in discovering, indicating that a gauge-dependent treatment might still give reasonable results when examining the global features of a model.

Perturbative effective field theory expansions for cosmological phase transitions

Guided by previous non-perturbative lattice simulations of a two-step electroweak phase transition, we reformulate the perturbative analysis of equilibrium thermodynamics for generic cosmological phase transitions in terms of effective field theory (EFT) expansions. Based on thermal scale hierarchies, we argue that the scale of many interesting phase transitions is in-between the soft and ultrasoft energy scales, which have been the focus of studies utilising high-temperature dimensional reduction. The corresponding EFT expansions provide a handle to control the perturbative expansion, and allow us to avoid spurious infrared divergences, imaginary parts, gauge dependence and renormalisation scale dependence that have plagued previous studies. As a direct application, we present a novel approach to two-step electroweak phase transitions, by constructing separate effective descriptions for two consecutive transitions. Our approach provides simple expressions for effective potentials separately in different phases, a numerically inexpensive method to determine thermodynamics, and significantly improves agreement with the non-perturbative lattice simulations.

Revisiting Gauge-Independent Kinetic Energy Densities in Meta-GGAs and Local Hybrid Calculations of Magnetizabilities.

In a recent study [J. Chem. Theory Comput. 2021, 17, 1457-1468], some of us examined the accuracy of magnetizabilities calculated with density functionals representing the local density approximation (LDA), generalized gradient approximation (GGA), meta-GGA (mGGA), as well as global hybrid (GH) and range-separated (RS) hybrid functionals by assessment against accurate reference values obtained with coupled-cluster theory with singles, doubles, and perturbative triples [CCSD(T)]. Our study was later extended to local hybrid (LH) functionals by Holzer et al. [J. Chem. Theory Comput. 2021, 17, 2928-2947]; in this work, we examine a larger selection of LH functionals, also including range-separated LH (RSLH) functionals and strong-correlation LH (scLH) functionals. Holzer et al. also studied the importance of the physically correct handling of the magnetic gauge dependence of the kinetic energy density (τ) in mGGA calculations by comparing the Maximoff-Scuseria formulation of τ used in our aforementioned study to the more physical current-density extension derived by Dobson. In this work, we also revisit this comparison with a larger selection of mGGA functionals. We find that the newly tested LH, RSLH, and scLH functionals outperform all of the functionals considered in the previous studies. The various LH functionals afford the seven lowest mean absolute errors while also showing remarkably small standard deviations and mean errors. Most strikingly, the best two functionals are scLHs that also perform remarkably well in cases with significant multiconfigurational character, such as the ozone molecule, which is traditionally excluded from statistical error evaluations due to its large errors with common density functionals.

Stop comparing resummation methods

I argue that the consistency of any resummation method can be established if the method follows a power counting derived from a hierarchy of scales. I.e. whether it encodes a top-down effective field theory. This resolves much confusion over which resummation method to use once an approximation scheme is settled on. And if no hierarchy of scales exists, you should be wary about resumming. I give evidence from the study of phase transitions in thermal field theory, where adopting a consistent power-counting scheme and performing a strict perturbative expansion dissolves many common problems of such studies: gauge dependence, strong renormalization scale dependence, the Goldstone boson catastrophe, IR divergences, imaginary potentials, mirages (illusory barriers), perturbative breakdown, and linear terms.

Scheme and gauge dependence of QCD fixed points at five loops

Scheme and gauge dependence of QCD fixed points at five loops

On the gauge dependence of scalar induced secondary gravitational waves during radiation and matter domination eras

On the gauge dependence of scalar induced secondary gravitational waves during radiation and matter domination eras

Relativistic matter bispectrum of cosmic structures on the light cone

Upcoming surveys of cosmic structures will probe scales close to the cosmological horizon, which opens up new opportunities for testing the cosmological concordance model to high accuracy. In particular, constraints on the squeezed bispectrum could rule out the single-field hypothesis during inflation. However, the squeezed bispectrum is also sensitive to dynamical effects of general relativity as well as interactions of matter with residual radiation from the early Universe. In this paper, we present a relativistic simulation pipeline that includes these relativistic effects consistently. We produce light cones and calculate the observed number counts of cold dark matter for five redshift bins between z = 0.55-2.25. We compare the relativistic results against reference Newtonian simulations by means of angular power- and bispectra. We find that the dynamical relativistic effects scale roughly inversely proportional to the multipole in the angular power spectrum, with a maximum amplitude of 10% for ℓ ≲ 5. By using a smoothing method applied to the binned bispectrum we detect the Newtonian bispectrum with very high significance. The purely relativistic part of the matter bispectrum, obtained by subtracting the Newtonian bispectrum from the relativistic one, is detected with a significance of ∼ 3σ, mostly limited by cosmic variance. We find that the pure dynamical relativistic effects accounts for up to 3% and 10% of the total amplitude, respectively in the squeezed and equilateral limits. Our relativistic pipeline for modelling ultra-large scales yields gauge-independent results as we compute observables consistently on the past light cone, while the Newtonian treatment employs approximations that leave some residual gauge dependence. A gauge-invariant approach is required in order to meet the expected level of precision of forthcoming probes of cosmic structures on ultra-large scales.

One-loop fermion-photon vertex in arbitrary gauge and dimensions: A novel approach

We compute a one-loop electron-photon vertex with fully off-shell external momenta in an arbitrary covariant gauge and space-time dimension. There exist numerous efforts in literature where a one-loop off-shell vertex is calculated by employing the standard first-order Feynman rules in different covariant gauges and space-time dimensions of interest. The tensor structure which decomposes this three-point vertex into the components transverse and longitudinal to the photon momentum gets intertwined in this first-order formalism. The Ward-Takahashi identity is explicitly invoked to untangle the two pieces and the results are expressed in a preferred basis of 12 spin amplitudes. We propose a novel approach based upon an efficient combination of the first- and second-order formalisms of quantum electrodynamics to compute this one-loop vertex. Among some conspicuous advantages is the fact that this less known second-order formalism separates the spin and scalar degrees of freedom of an electron interacting electromagnetically. More noticeably, the longitudinal and transverse contributions naturally disentangle from the onset in our approach. Moreover, this decomposition leads to identities between one-loop scalar Feynman integrals with higher powers in the propagators and shifted space-time dimensions that can be used to prove the Ward-Takahashi identity at one-loop order without the need to evaluate any Feynman integral. Additionally, this natural decomposition allows us to establish the gauge independence of the Pauli form factor through explicit cancellations of scalar Feynman integrals that depend on the gauge parameter. These cancellations naturally lead to a compact expression for the Pauli form factor in arbitrary dimensions. Wherever necessary and insightful, we make comparisons with earlier works.

Gauge dependence of the quark gap equation: An exploratory study

We study the gauge dependence of the quark propagator in quantum chromodynamics by solving the gap equation with a nonperturbative quark-gluon vertex which is constrained by longitudinal and transverse Slavnov-Taylor identities, the discrete charge conjugation and parity symmetries and which is free of kinematic singularities in the limit of equal incoming and outgoing quark momenta. We employ gluon propagators in renormalizable $R_\xi$ gauges obtained in lattice QCD studies. We report the dependence of the nonperturbative quark propagator on the gauge parameter, in particular we observe an increase, proportional to the gauge-fixing parameter, of the mass function in the infrared domain, whereas the wave renormalization decreases within the range $0 \leq \xi \leq 1$ considered here. The chiral quark condensate reveals a mild gauge dependence in the region of $\xi$ investigated. We comment on how to build and improve upon this exploratory study in future in conjunction with generalized gauge covariance relations for QCD.

How arbitrary are perturbative calculations of the electroweak phase transition?

We investigate the extent to which perturbative calculations of the electroweak phase transition are arbitrary and uncertain, owing to their gauge, renormalisation scale and scheme dependence, as well as treatments of the Goldstone catastrophe and daisy diagrams. Using the complete parameter space of the Standard Model extended by a real scalar singlet with a ℤ2 symmetry as a test, we explore the properties of the electroweak phase transition in general Rξ and covariant gauges, OS and overline{textrm{MS}} renormalisation schemes, and for common treatments of the Goldstone catastrophe and daisy diagrams. Reassuringly, we find that different renormalisation schemes and different treatments of the Goldstone catastrophe and daisy diagrams typically lead to only modest changes in predictions for the critical temperature and strength of the phase transition. On the other hand, the gauge and renormalisation scale dependence may be significant, and often impact the existence of the phase transition altogether.

<i>Ab Initio</i> Local-Energy and Local-Stress Calculations for Materials Science and Engineering

Revealing atomic-scale distributions of energy and stress in defective or complex systems, based on the behavior of electrons, should contribute much to materials science and engineering, while only few practical ab initio methods were developed for this purpose. Thus, we developed computational techniques of local-energy and local-stress calculations within the plane-wave PAW (projector augmented wave)-GGA (generalized gradient approximation) framework. This is natural extension of ab initio energy-density and stress-density schemes, while the inherent gauge dependency is removed by integrating these densities in each local region where the contained gauge-dependent terms are integrated to be zero. In this overview, we explain our scheme with some details and discuss the concepts or physical meanings of local energy and local stress via the comparison with related schemes using similar densities, LCAO (linear combination of atomic orbitals) methods, Green’s function formulation implemented by multiple scattering or TB (tight-binding) methods, or EAM (embedded-atom method) potentials. We present recent applications to metallic surfaces, grain boundaries (GBs) with and without solute segregation, tensile tests of metallic GBs, local elastic constants of microstructures in alloys, and machine-learning based GB-energy prediction, where the local-energy and local-stress analyses provide novel aspects of phenomena, deep insights into the mechanism, and effective data for novel machine-learning based modelling. We discuss unsettled issues and future applications, especially for large-scale metallic systems.

Non-Abelian Gauge Theories with Composite Fields in the Background Field Method

Non-Abelian gauge theories with composite fields are examined in the background field method. Generating functionals of Green’s functions for a Yang–Mills theory with composite and background fields are introduced, including the generating functional of vertex Green’s functions (effective action). The corresponding Ward identities are obtained, and the issue of gauge dependence is investigated. A gauge variation of the effective action is found in terms of a nilpotent operator depending on the composite and background fields. On-shell independence from the choice of gauge fixing for the effective action is established. In the study of the Ward identities and gauge dependence, finite field-dependent BRST transformations with a background field are introduced and employed on a systematic basis. On the one hand, this involves the consideration of (modified) Ward identities with a field-dependent anticommuting parameter, also depending on a non-trivial background. On the other hand, the issue of gauge dependence is studied with reference to a finite variation of the gauge Fermion. The concept of a joint introduction of composite and background fields to non-Abelian gauge theories is exemplified by the Gribov–Zwanziger theory, including the case of a local BRST-invariant horizon, and also by the Volovich–Katanaev model of two-dimensional gravity with dynamical torsion.

Ionization dynamics and gauge invariance

Photoionization is one of the most fundamental processes in laser-matter interaction. It plays a crucial role also from the practical point of view since the electron-density dynamics in a gaseous medium is a process that affects the field propagation. Photoionization has been addressed in different regimes: linear, multiphoton, and tunneling. The ideal tool that allows for the description of ionization, in all aforementioned regimes, is the numerical evaluation of the time-dependent Schr\"odinger equation. The determination of the electron density needs the computation of the time-dependent ionization probability which unfortunately is an ambiguous quantity due to the gauge dependence of the latter. In this paper, we show how to overcome this difficulty by properly defining the time-dependent ionization probability in the context of the resolvent operator method. We show in particular that the velocity gauge allows for a definition of adiabatic states that is suitable to define an ionization threshold at all times during the interaction to compute ionization probability. Applications to linear, multiphoton, and tunneling regimes are presented for the one-dimensional problem. The extension to the nondipole case is discussed and we show that time-dependent ionization probability cannot be defined unambiguously due to the introduction of the magnetic-field component. We also discuss the case of gauge invariance in a subspace of the eigenbasis defined by the Hamiltonian.