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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 55 records · Page 3

Geometric integration of classical spin dynamics via a mean-field Schrödinger equation

The Landau-Lifshitz equation describes the time evolution of magnetic dipoles and can be derived by taking the classical limit of a quantum mechanical spin Hamiltonian. To take this limit, one constrains the many-body quantum state to a tensor product of coherent states, thereby neglecting entanglement between sites. Expectation values of the quantum spin operators produce the usual classical spin dipoles. One may also consider expectation values of polynomials of the spin operators, leading to quadrupole and higher-order spin moments, which satisfy a dynamical equation of motion that generalizes the Landau-Lifshitz dynamics [Zhang and Batista, Phys. Rev. B 104, 104409 (2021)]. Here we reformulate the dynamics of these N 2 –1 generalized spin components as a mean-field Schrödinger equation on the N-dimensional coherent state. Furthermore, this viewpoint suggests efficient integration methods that respect the local symplectic structure of the classical spin dynamics.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

SDA: a symbolic differential algebra package in C++

Truncated Power Series Algebra (TPSA), or Differential Algebra (DA), is a well-established tool in accelerator physics, commonly used for generating high-order maps of dynamic systems, as well as in symplectic tracking, normal form analysis, verified integration, optimization, and fast multipole methods. This package is the first to perform symbolic DA computations, enabling traceability of initial condition contributions and runtime reduction for repeated DA calculations, potentially expanding DA’s applications.

97 MATHEMATICS AND COMPUTING↗

Modeling Transverse Space Charge effects in IOTA with pyORBIT

The role and mitigation of space charge effects are important aspects of the beam physics research to be performed at the Integrable Optics Test Accelerator (IOTA) at Fermilab. The impact of nonlinear integrability (partial and complete) on space charge driven incoherent and coherent resonances will be a new feature of this accelerator and has the potential to influence the design of future low energy proton synchrotrons. In this report we model transverse space charge effects using the PIC code pyORBIT. First we benchmark the single particle tracking results against MADX with checks on symplecticity, tune footprints, and dynamic aperture in a partially integrable lattice realized with a special octupole string insert. Our space charge calculations begin with an examination of the 4D symplecticity. Short term tracking is done first with the initial bare lattice and then with a matching of the rms values with space charge. Next, we explore slow initialization of charge as a technique to establish steady state and reduce emittance growth and beam loss following injection into a mismatched lattice. We establish values of space charge simulation parameters so as to ensure numerical convergence. Finally, we compare the simulated space charge induced tune shifts and footprints against theory.

43 PARTICLE ACCELERATORS↗

Nearly Periodic Maps and Geometric Integration of Noncanonical Hamiltonian Systems

Abstract M. Kruskal showed that each continuous-time nearly periodic dynamical system admits a formal U (1)-symmetry, generated by the so-called roto-rate. When the nearly periodic system is also Hamiltonian, Noether’s theorem implies the existence of a corresponding adiabatic invariant. We develop a discrete-time analog of Kruskal’s theory. Nearly periodic maps are defined as parameter-dependent diffeomorphisms that limit to rotations along a U (1)-action. When the limiting rotation is non-resonant, these maps admit formal U (1)-symmetries to all orders in perturbation theory. For Hamiltonian nearly periodic maps on exact presymplectic manifolds, we prove that the formal U (1)-symmetry gives rise to a discrete-time adiabatic invariant using a discrete-time extension of Noether’s theorem. When the unperturbed U (1)-orbits are contractible, we also find a discrete-time adiabatic invariant for mappings that are merely presymplectic, rather than Hamiltonian. As an application of the theory, we use it to develop a novel technique for geometric integration of non-canonical Hamiltonian systems on exact symplectic manifolds.

97 MATHEMATICS AND COMPUTING↗

The geometric theory of charge conservation in particle-in-cell simulations

In recent years, several gauge-symmetric particle-in-cell (PIC) methods have been developed whose simulations of particles and electromagnetic fields exactly conserve charge. While it is rightly observed that these methods’ gauge symmetry gives rise to their charge conservation, this causal relationship has generally been asserted via ad hoc derivations of the associated conservation laws. In this work, we develop a comprehensive theoretical grounding for charge conservation in gauge-symmetric Lagrangian and Hamiltonian PIC algorithms. For Lagrangian variational PIC methods, we apply Noether’s second theorem to demonstrate that gauge symmetry gives rise to a local charge conservation law as an off-shell identity. For Hamiltonian splitting methods, we show that the momentum map establishes their charge conservation laws. We define a new class of algorithms – gauge-compatible splitting methods – that exactly preserve the momentum map associated with a Hamiltonian system’s gauge symmetry – even after time discretization. This class of algorithms affords splitting schemes a decided advantage over alternative Hamiltonian integrators. We apply this general technique to design a novel, explicit, symplectic, gauge-compatible splitting PIC method, whose momentum map yields an exact local charge conservation law. Finally, our study clarifies the appropriate initial conditions for such schemes and examines their symplectic reduction.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Clebsch canonization of Lie–Poisson systems

We propose a systematic procedure called the Clebsch canonization for obtaining a canonical Hamiltonian system that is related to a given Lie–Poisson equation via a momentum map. We describe both coordinate and geometric versions of the procedure, the latter apparently for the first time. We also find another momentum map so that the pair of momentum maps constitute a dual pair under a certain condition. The dual pair gives a concrete realization of what is commonly referred to as collectivization of Lie–Poisson systems. It also implies that solving the canonized system by symplectic Runge–Kutta methods yields so-called collective Lie–Poisson integrators that preserve the coadjoint orbits and hence the Casimirs exactly. We give a couple of examples, including the Kida vortex and the heavy top on a movable base with controls, which are Lie–Poisson systems on $\mathfrak{so}$ (2,1)* and ($\mathfrak{se}$ (3) ⋉ $\mathbb{R}^3$)* and, respectively.

97 MATHEMATICS AND COMPUTING↗

Mapping the stability field of Jupiter Trojans

Jupiter Trojans are a remnant of outer solar system planetesimals captured into stable or quasistable libration about the 1:1 resonance with the mean motion of Jupiter. The observed swarms of Trojans may provide insight into the original mass of condensed solids in the zone from which the Jovian planets accumulated, provided that the mechanisms of capture can be understood. As the first step toward this understanding, the stability field of Trojans were mapped in the coordinate proper eccentricity, e(sub p), and libration amplitude, D. To accomplish this mapping, the orbits of 100 particles with e(sub p) in the range of 0 to 0.8 and D in the range 0 to 140 deg were numerically integrated. Orbits of the Sun, the four Jovian planets, and the massless particles were integrated as a full N-body system, in a barycentric frame using fourth order symplectic scheme.

Levison, H. F.↗

Celestial IR divergences and the effective action of supertranslation modes

Infrared divergences in perturbative gravitational scattering amplitudes have been recently argued to be governed by the two-point function of the supertranslation Goldstone mode on the celestial sphere. We show that the form of this celestial two-point function simply derives from an effective action that also controls infrared divergences in the symplectic structure of General Relativity with asymptotically flat boundary conditions. This effective action finds its natural place in a path integral formulation of a celestial conformal field theory, as we illustrate by re-deriving the infrared soft factors in terms of celestial correlators. Our analysis relies on a well-posed action principle close to spatial infinity introduced by Compère and Dehouck.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Chiral algebra, localization, modularity, surface defects, and all that

We study the 2D vertex operator algebra (VOA) construction in 4D N = 2 superconformal field theories on S 3 × S 1 , focusing on both old puzzles and new observations. The VOA lives on a two-torus T 2 ⊂ S 3 × S 1 , it is 1 2 Z -graded, and this torus is equipped with the natural choice of spin structure (1,0) for the Z + 1 2 -graded operators, corresponding to the NS sector vacuum character. By analyzing the possible refinements of the Schur index that preserves the VOA, we find that it admits discrete deformations, which allows access to the remaining spin structures (1,1), (0,1), and (0,0), of which the latter two involve the inclusion of a particular surface defect. For Lagrangian theories, we perform the detailed analysis: we describe the natural supersymmetric background, perform localization, and derive the gauged symplectic boson action on a torus in any spin structure. In the absence of flavor fugacities, the 2D and 4D path integrals precisely match, including the Casimir factors. We further analyze the 2D theory: we identify its integration cycle and the two-point functions and interpret flavor holonomies as screening charges in the VOA. Next, we make some observations about modularity; the T-transformation acts on our four partition functions and lifts to a large diffeomorphism on S 3 × S 1 . More interestingly, we generalize the four partition functions on the torus to an infinite family labeled by both the spin structure and the integration cycle inside the complexified maximal torus of the gauge group. Members of this family transform into one another under the full modular group, and we confirm the recent observation that the S-transform of the Schur index in Lagrangian theories exhibits logarithmic behavior. Finally, we comment on how locally our background reproduces the Ω-background.

97 MATHEMATICS AND COMPUTING↗

Symplectic machine learning model for fast simulation of space-charge effects

Symplectic simulation of space-charge effects is crucial for the design and operation of high-intensity particle accelerators. Traditional methods for simulating these effects are often computationally expensive, resulting in significant overhead. In this work, we introduce a generative model based on a U-Net architecture within a generative adversarial network framework to efficiently simulate space-charge effects. The model is trained to predict the transverse multiparticle space-charge Hamiltonian, which can be physically computed using a gridless spectral method. The one-step symplectic transverse transfer map for the particles is then obtained by differentiating the predicted Hamiltonian. Benchmarking results demonstrate that this generative model achieves an order of magnitude higher computational efficiency compared to the spectral method, providing a highly efficient alternative for simulating space-charge effects with a large number of particles. By maintaining symplecticity, the model effectively preserves the phase-space structure and mitigates nonphysical errors in long-term simulations. This model has been integrated into jutrack, a novel autodifferentiable accelerator modeling code developed in the julia programming language.

Beam code development & simulation techniques↗

Fast neural Poincaré maps for toroidal magnetic fields

Poincaré maps for toroidal magnetic fields are routinely employed to study gross confinement properties in devices built to contain hot plasmas. In most practical applications, evaluating a Poincaré map requires numerical integration of a magnetic field line, a process that can be slow and that cannot be easily accelerated using parallel computations. We propose a novel neural network architecture, the HénonNet, and show that it is capable of accurately learning realistic Poincaré maps from observations of a conventional field-line-following algorithm. After training, such learned Poincaré maps evaluate much faster than the field-line integration method. Moreover, the HénonNet architecture exactly reproduces the primary physics constraint imposed on field-line Poincaré maps: flux preservation. Furthermore, this structure-preserving property is the consequence of each layer in a HénonNet being a symplectic map. We demonstrate empirically that a HénonNet can learn to mock the confinement properties of a large magnetic island by using coiled hyperbolic invariant manifolds to produce a sticky chaotic region at the desired island location. This suggests a novel approach to designing magnetic fields with good confinement properties that may be more flexible than ensuring confinement using KAM tori.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Chapter Six - Derivation, cross-validation, and comparison of analytic formulas for electrostatic deflector aberrations

Here, we derived first and second order analytic aberration formulas in the horizontal transverse plane for an electrostatic deflector specified by the reference orbit radius, the central angle spanning the deflector, and its inhomogeneity coefficients. The derivation was performed using an iterative order-by-order perturbation method in a Frenet–Serret beamline coordinate system. We produced a C program edabrt for calculation of the first and second order aberrations using the formulas that we derived. The electrostatic deflector aberration formulas from Wollnik (1965) disagree with COSY INFINITY and the aberration formulas that we derived here, and they also deviate from the first and second order symplecticity conditions. The reason for this discrepancy is that the aberration formulas from Wollnik (1965) consider only motion in the main field of the deflector and do not properly account for fringe field effects, in particular the necessarily occurring change of kinetic energy due to the change in potential. The code GIOS uses electrostatic aberration formulas from Wollnik (1965) and exhibits the same discrepancy. We performed a comparison of first and second order electrostatic deflector aberrations for (1) the analytic formulas derived in this work, (2) differential-algebraic (DA) numerical integration of the equations of motion using the code COSY INFINITY, (3) the aberration formulas from Wollnik (1965), (4) aberrations computed using the code GIOS, and (5) the aberration formulas from Wollnik (1965) adjusted to account for the occurring change in potential. An electrostatic spherical deflector and an electrostatic cylindrical deflector were used as test cases for this comparison. There is excellent agreement between methods (1), (2), and (5), and these three methods satisfy the first and second order symplecticity conditions.

43 PARTICLE ACCELERATORS↗

The Zoo of Opers and Dualities

Abstract We investigate various spaces of $SL(r+1)$-opers and their deformations. For each type of such opers, we study the quantum/classical duality, which relates quantum integrable spin chains with classical solvable many body systems. In this context, quantum/classical dualities serve as an interplay between two different coordinate systems on the space of opers. We also establish correspondences between the underlying oper spaces, which recently had multiple incarnations in symplectic duality and bispectral duality.

Mathematics↗

New Time Integrators and Capabilities in SUNDIALS Versions 6.2.0-7.4.0

SUNDIALS is a well-established numerical library that provides robust and efficient time integrators and nonlinear solvers. This article overviews several significant improvements and new features added over the last 3 years to support scientific simulations run on high-performance computing systems. Notably, three new classes of one-step methods have been implemented: low storage Runge–Kutta, symplectic partitioned Runge–Kutta, and operator splitting. In addition, we describe new timestep adaptivity support for multirate methods, adjoint sensitivity analysis capabilities for explicit Runge–Kutta methods, additional options for Anderson acceleration in nonlinear solvers, and improved error handling and logging.

Computer science↗

Charged particle motion in spherically symmetric distributions of magnetic monopoles

The classical equations of motion of a charged particle in a spherically symmetric distribution of magnetic monopoles can be transformed into a system of linear equations, thereby providing a type of integrability. In the case of a single monopole, the solution was given long ago by Poincaré. In the case of a uniform distribution of monopoles, the solution can be expressed in terms of parabolic cylinder functions (essentially the eigenfunctions of an inverted harmonic oscillator). Further, this solution is relevant to recent studies of nonassociative star products, symplectic lifts of twisted Poisson structures, and fluids and plasmas of electric and magnetic charges.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Solar System Dynamics

In these 18 years, the research has touched every major dynamical problem in the solar system, including: the effect of chaotic zones on the distribution of asteroids, the delivery of meteorites along chaotic pathways, the chaotic motion of Pluto, the chaotic motion of the outer planets and that of the whole solar system, the delivery of short period comets from the Kuiper belt, the tidal evolution of the Uranian arid Galilean satellites, the chaotic tumbling of Hyperion and other irregular satellites, the large chaotic variations of the obliquity of Mars, the evolution of the Earth-Moon system, and the resonant core- mantle dynamics of Earth and Venus. It has introduced new analytical and numerical tools that are in widespread use. Today, nearly every long-term integration of our solar system, its subsystems, and other solar systems uses algorithms that was invented. This research has all been primarily Supported by this sequence of PGG NASA grants. During this period published major investigations of tidal evolution of the Earth-Moon system and of the passage of the Earth and Venus through non-linear core-mantle resonances were completed. It has published a major innovation in symplectic algorithms: the symplectic corrector. A paper was completed on non-perturbative hydrostatic equilibrium.

Wisdom, Jack↗

Polynomial approximation of Poincare maps for Hamiltonian system

Different methods are proposed and tested for transforming a non-linear differential system, and more particularly a Hamiltonian one, into a map without integrating the whole orbit as in the well-known Poincare return map technique. We construct piecewise polynomial maps by coarse-graining the phase-space surface of section into parallelograms and using either only values of the Poincare maps at the vertices or also the gradient information at the nearest neighbors to define a polynomial approximation within each cell. The numerical experiments are in good agreement with both the real symplectic and Poincare maps.

Froeschle, Claude↗

Quadrature Based Neural Network Learning of Stochastic Hamiltonian Systems

Hamiltonian Neural Networks (HNNs) provide structure-preserving learning of Hamiltonian systems. In this paper, we extend HNNs to structure-preserving inversion of stochastic Hamiltonian systems (SHSs) from observational data. We propose the quadrature-based models according to the integral form of the SHSs’ solutions, where we denoise the loss-by-moment calculations of the solutions. The integral pattern of the models transforms the source of the essential learning error from the discrepancy between the modified Hamiltonian and the true Hamiltonian in the classical HNN models into that between the integrals and their quadrature approximations. This transforms the challenging task of deriving the relation between the modified and the true Hamiltonians from the (stochastic) Hamilton–Jacobi PDEs, into the one that only requires invoking results from the numerical quadrature theory. Meanwhile, denoising via moments calculations gives a simpler data fitting method than, e.g., via probability density fitting, which may imply better generalization ability in certain circumstances. Numerical experiments validate the proposed learning strategy on several concrete Hamiltonian systems. The experimental results show that both the learned Hamiltonian function and the predicted solution of our quadrature-based model are more accurate than that of the corrected symplectic HNN method on a harmonic oscillator, and the three-point Gaussian quadrature-based model produces higher accuracy in long-time prediction than the Kramers–Moyal method and the numerics-informed likelihood method on the stochastic Kubo oscillator as well as other two stochastic systems with non-polynomial Hamiltonian functions. Moreover, the Hamiltonian learning error εH arising from the Gaussian quadrature-based model is lower than that from Simpson’s quadrature-based model. These demonstrate the superiority of our approach in learning accuracy and long-time prediction ability compared to certain existing methods and exhibit its potential to improve learning accuracy via applying precise quadrature formulae.

Mathematics↗