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At least 739 records · Page 41

Chemical kinetics and modeling of planetary atmospheres

A unified overview is presented for chemical kinetics and chemical modeling in planetary atmospheres. The recent major advances in the understanding of the chemistry of the terrestrial atmosphere make the study of planets more interesting and relevant. A deeper understanding suggests that the important chemical cycles have a universal character that connects the different planets and ultimately link together the origin and evolution of the solar system. The completeness (or incompleteness) of the data base for chemical kinetics in planetary atmospheres will always be judged by comparison with that for the terrestrial atmosphere. In the latter case, the chemistry of H, O, N, and Cl species is well understood. S chemistry is poorly understood. In the atmospheres of Jovian planets and Titan, the C-H chemistry of simple species (containing 2 or less C atoms) is fairly well understood. The chemistry of higher hydrocarbons and the C-N, P-N chemistry is much less understood. In the atmosphere of Venus, the dominant chemistry is that of chlorine and sulfur, and very little is known about C1-S coupled chemistry. A new frontier for chemical kinetics both in the Earth and planetary atmospheres is the study of heterogeneous reactions. The formation of the ozone hole on Earth, the ubiquitous photochemical haze on Venus and in the Jovian planets and Titan all testify to the importance of heterogeneous reactions. It remains a challenge to connect the gas phase chemistry to the production of aerosols.

Yung, Yuk L.↗

The need for an intermediate mass scale in GUTs

The minimal SU(5) grand unified field theory (GUT) model fails to resolve the strong charge parity (CP) problem, suffers from the cosmological monopole problem, sheds no light on the nature of the 'dark' mass in the universe, and predicts an unacceptably low value for the baryon asymmetry. All these problems can be overcome in suitable grand unified axion models with an intermediate mass scale of about 10 to the 11th power to 10 to the 12th power GeV. An example based on the gauge group SO(10) is presented. Among other things, it predicts that the axions comprise the 'dark' mass in the universe, and that there exists a galactic monopole flux of 10 to the -8th power to 10 to the -7th power/sq cm/yr. Other topics that are briefly discussed include proton decay, family symmetry, neutrino masses and the gauge hierarchy problem.

Shafi, Q.↗

Anomalous is ubiquitous

Brownian motion is widely considered the quintessential model of diffusion processes-the most elemental random transport processes in Science and Engineering. Yet so, examples of diffusion processes displaying highly non-Brownian statistics-commonly termed 'Anomalous Diffusion' processes-are omnipresent both in the natural sciences and in engineered systems. The scientific interest in Anomalous Diffusion and its applications is growing exponentially in the recent years. In this Paper we review the key statistics of Anomalous Diffusion processes: sub-diffusion and super-diffusion, long-range dependence and the Joseph effect, Levy statistics and the Noah effect, and 1/f noise. We further present a theoretical model-generalizing the Einstein-Smoluchowski diffusion model-which provides a unified explanation for the prevalence of Anomalous Diffusion statistics. Our model shows that what is commonly perceived as 'anomalous' is in effect ubiquitous. - Highlights: > The article provides an overview of Anomalous Diffusion (AD) statistics. > The Einstein-Smoluchowski diffusion model is extended and generalized. > The generalized model universally generates AD statistics. > A unified 'universal macroscopic explanation' for AD statistics is established. > AD statistics are shown to be fundamentally connected to robustness.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Multi-fidelity microstructure-induced uncertainty quantification by advanced Monte Carlo methods

Quantifying uncertainty associated with the microstructure variation of a material can be a computationally daunting task, especially when dealing with advanced constitutive models and fine mesh resolutions in the crystal plasticity finite element method (CPFEM). Numerous studies have been conducted regarding the sensitivity of material properties and performance to the mesh resolution and choice of constitutive model. However, a unified approach that accounts for various fidelity parameters, such as mesh resolutions, integration time-steps and constitutive models simultaneously is currently lacking. Further, this paper proposes a novel uncertainty quantification (UQ) approach for computing the properties and performance of homogenized materials using CPFEM, that exploits a hierarchy of approximations with different levels of fidelity. In particular, we illustrate how multi-level sampling methods, such as multi-level Monte Carlo (MLMC) and multi-index Monte Carlo (MIMC), can be applied to assess the impact of variations in the microstructure of polycrystalline materials on the predictions of homogenized materials properties. We show that by adaptively exploiting the fidelity hierarchy, we can significantly reduce the number of microstructures required to reach a certain prescribed accuracy. Finally, we show how our approach can be extended to a multi-fidelity framework, where we allow the underlying constitutive model to be chosen from either a phenomenological plasticity model or a dislocation-density-based model.

36 MATERIALS SCIENCE↗

Electroweak nuclear response at moderate momentum transfer

We discuss the convergence of the expansion of the nuclear electroweak current in powers of |k|/M, where M is the nucleon mass and k denotes either the momentum transfer or the momentum of the struck nucleon. We have computed the electron and neutrino scattering cross sections off uniform nuclear matter at equilibrium density using correlated wave functions and the cluster expansion formalism. The results of our work suggest that the proposed approach provides accurate estimates of the measured electron scattering cross sections. On the other hand, the description of the current based on the widely used leading-order approximation does not appear to be adequate, even at momentum transfer as low as 300 MeV.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

HPC-FAIR: A Framework Managing Data and AI Models for Analyzing and Optimizing Scientific Applications

The increasing reliance on machine learning (ML) to analyze and optimize large-scale scientific applications on supercomputers faces a significant bottleneck: the lack of readily available, high-quality training datasets and the difficulty in reusing existing AI models. This project was motivated by the urgent need to address the “FAIR” principles (Findability, Accessibility, Interoperability, Reusability) for both training datasets and AI models in the high-performance computing (HPC) domain. The project developed HPC-FAIR, a high-performance computing data management framework designed to centralize HPC-related datasets and AI models within a unified hub. To ensure interoperability, the framework established a standardized representation and vocabulary (ontology) for both data and models. HPC-FAIR also implemented automated workflows to streamline data processing, model access, and benchmarking. Additionally, the project focused on optimizing data harnessing efficiency through advanced techniques like deep reuse and compression-based analytics.

97 MATHEMATICS AND COMPUTING↗

Early LHC phenomenology of Yukawa-bound heavy QQ mesons

Current limits from the LHC on fourth generation quarks are already at the unitarity bound of 500 GeV or so. If they exist, the strong Yukawa couplings are turning nonperturbative, and may form bound states. We study the domain of m{sub b'} and m{sub t'} in the range of 500 to 700 GeV, where we expect binding energies are mainly of Yukawa origin, with QCD subdominant. To be consistent with electroweak precision tests, the t' and b' quarks have to be nearly degenerate, exhibiting a new 'isospin'. Comparing relativistic expansion with a relativistic bound state approach, we find the most interesting is the production of a color octet, isosinglet vector meson (a 'gluon-prime') via qq-bar{yields}{omega}{sub 8}. Leading decay modes are {pi}{sub 8}{sup {+-}}W{sup {+-}}, {pi}{sub 8}{sup 0}Z{sup 0}, and constituent quark decay, with qq and tt-bar' and bb' subdominant. The color octet, isovector pseudoscalar {pi}{sub 8} meson decays via constituent quark decay, or to Wg. These decay rates are parameterized by the decay constant, the binding energy and mass differences, and V{sub tb'}. For small V{sub t'b}, one could have a spectacular signal of WWg, where a soft W accompanies a very massive Wg pair. In general, however, one has high multiplicity signals with b, W, and t jet substructures that are not so different from the t't-bar' and b'b-bar' search.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

OpenFerro v0.1.0

OpenFerro is a Python package for on-lattice atomistic dynamics simulation of ferroic materials. OpenFerro is based on JAX, a high-performance linear algebra package supporting auto-differentiation and GPU acceleration. OpenFerro is designed to minimize the effort required to build on-lattice Hamiltonian models, and to perform molecular dynamics (MD) and Landau-Lifshitz-Gilbert simulations. Unlike existing codes, OpenFerro provides a unified interface to model different types of local order parameters.

Xie, Pinchen [Lawrence Berkeley National Laborator↗

Dynamics Behind the Quark Mass Hierarchy and Electroweak Symmetry breaking

I review the dynamics in a new class of models describing the quark mass hierarchy, suggested recently by Michio Hashimoto and the author. In this class, the dynamics primarily responsible for electroweak symmetry breaking (EWSB) leads to the mass spectrum of quarks with no (or weak) isospin violation. Moreover, the values of these masses are of the order of the observed masses of the down-type quarks. Then, strong (although subcritical) horizontal diagonal interactions for the t quark plus horizontal flavor-changing neutral interactions between different families lead (with no fine tuning) to a realistic quark mass spectrum. In this scenario, many composite Higgs bosons occur. A concrete model with the dynamical EWSB with the fourth family is described in detail.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Triviality and vacuum stability bounds in the three-loop neutrino mass model

We study theoretical constraints on the parameter space under the conditions from vacuum stability and triviality in the three-loop radiative seesaw model with TeV-scale right-handed neutrinos which are odd under the Z{sub 2} parity. In this model, some of the neutrino Yukawa coupling constants can be of the order of 1. The requirement of a strongly first order phase transition for successful electroweak baryogenesis also prefers order-one coupling constants in the scalar sector. Hence, it is important to clarify whether this model satisfies those theoretical conditions up to a given cutoff scale. It is found that the model can be consistent up to the scale above 10 TeV in the parameter region where the neutrino data, the lepton-flavor violation data, the thermal relic abundance of dark matter as well as the requirement from the strongly first order phase transition are satisfied.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Neutrino Scattering on Atomic Electrons in Searches for the Neutrino Magnetic Moment

The scattering of a neutrino on atomic electrons is considered in the situation where the energy transferred to the electrons is comparable to the characteristic atomic energies, as relevant to the current experimental search for the neutrino magnetic moment. The process is induced by the standard electroweak interaction as well as by the possible neutrino magnetic moment. Quantum-mechanical sum rules are derived for the inclusive cross section at a fixed energy deposited in the atomic system, and it is shown that the differential over the energy transfer cross section is given, modulo very small corrections, by the same expression as for free electrons, once all possible final states of the electronic system are taken into account. Thus, the atomic effects effectively cancel in the inclusive process.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

An approach to solving large reliability models

This paper describes a unified approach to the problem of solving large realistic reliability models. The methodology integrates behavioral decomposition, state trunction, and efficient sparse matrix-based numerical methods. The use of fault trees, together with ancillary information regarding dependencies to automatically generate the underlying Markov model state space is proposed. The effectiveness of this approach is illustrated by modeling a state-of-the-art flight control system and a multiprocessor system. Nonexponential distributions for times to failure of components are assumed in the latter example. The modeling tool used for most of this analysis is HARP (the Hybrid Automated Reliability Predictor).

Boyd, Mark A.↗

Multimetric extension of the parametrized post-Newtonian formalism: Experimental consistency of repulsive gravity

Recently we discussed a multimetric gravity theory containing several copies of standard model matter each of which couples to its own metric tensor. This construction contained dark matter sectors interacting repulsively with the visible matter sector and was shown to lead to cosmological late-time acceleration. In order to test the theory with high-precision experiments within the solar system, we here construct a simple extension of the parametrized post-Newtonian (PPN) formalism for multimetric gravitational backgrounds. We show that a simplified version of this extended formalism allows the computation of a subset of the PPN parameters from the linearized field equations. Applying the simplified formalism we find that the PPN parameters of our theory do not agree with the observed values, but we are able to improve the theory so that it becomes consistent with experiments of post-Newtonian gravity and still features its promising cosmological properties.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Probabilistic and maximum entropy modeling of chemical reaction systems: Characteristics and comparisons to mass action kinetic models

We demonstrate and characterize a first-principles approach to modeling the mass action dynamics of metabolism. Starting from a basic definition of entropy expressed as a multinomial probability density using Boltzmann probabilities with standard chemical potentials, we derive and compare the free energy dissipation and the entropy production rates. We express the relation between entropy production and the chemical master equation for modeling metabolism, which unifies chemical kinetics and chemical thermodynamics. Because prediction uncertainty with respect to parameter variability is frequently a concern with mass action models utilizing rate constants, we compare and contrast the maximum entropy model, which has its own set of rate parameters, to a population of standard mass action models in which the rate constants are randomly chosen. We show that a maximum entropy model is characterized by a high probability of free energy dissipation rate and likewise entropy production rate, relative to other models. We then characterize the variability of the maximum entropy model predictions with respect to uncertainties in parameters (standard free energies of formation) and with respect to ionic strengths typically found in a cell.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Nucleon Structure in the Search for New Physics

We report on recent results on nucleon structure that are helping guide the search for new physics at the precision frontier. Results discussed include the electroweak elastic form factors, charge symmetry breaking in parton distributions and the strangeness content of the nucleon.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Electromagnetic moments of quasistable particle

We deal with the problem of assigning electromagnetic moments to a quasistable particle (i.e., a particle with mass located at the particle's decay threshold). In this case, an application of a small external electromagnetic field changes the energy in a nonanalytic way, which makes it difficult to assign definitive moments. On the example of a spin-1/2 field with mass M{sub *} interacting with two fields of masses M and m, we show how a conventionally defined magnetic dipole moment diverges at M{sub *}=M+m. We then show that the conventional definition makes sense only when the values of the applied magnetic field B satisfy |eB|/2M{sub *}<<|M{sub *}-M-m|. We discuss implications of these results to existing studies in electroweak theory, chiral effective-field theory, and lattice QCD.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗