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At least 217 records · Page 12

Bayesian optimization with active learning of design constraints using an entropy-based approach

Abstract The design of alloys for use in gas turbine engine blades is a complex task that involves balancing multiple objectives and constraints. Candidate alloys must be ductile at room temperature and retain their yield strength at high temperatures, as well as possess low density, high thermal conductivity, narrow solidification range, high solidus temperature, and a small linear thermal expansion coefficient. Traditional Integrated Computational Materials Engineering (ICME) methods are not sufficient for exploring combinatorially-vast alloy design spaces, optimizing for multiple objectives, nor ensuring that multiple constraints are met. In this work, we propose an approach for solving a constrained multi-objective materials design problem over a large composition space, specifically focusing on the Mo-Nb-Ti-V-W system as a representative Multi-Principal Element Alloy (MPEA) for potential use in next-generation gas turbine blades. Our approach is able to learn and adapt to unknown constraints in the design space, making decisions about the best course of action at each stage of the process. As a result, we identify 21 Pareto-optimal alloys that satisfy all constraints. Our proposed framework is significantly more efficient and faster than a brute force approach.

36 MATERIALS SCIENCE↗

The EFT-hedron

We re-examine the constraints imposed by causality and unitarity on the low-energy effective field theory expansion of four-particle scattering amplitudes, exposing a hidden “totally positive” structure strikingly similar to the positive geometries associated with grassmannians and amplituhedra. This forces the infinite tower of higher-dimension operators to lie inside a new geometry we call the “EFT-hedron”. We initiate a systematic investigation of the boundary structure of the EFT-hedron, giving infinitely many linear and non-linear inequalities that must be satisfied by the EFT expansion in any theory. We illustrate the EFT-hedron geometry and constraints in a wide variety of examples, including new consistency conditions on the scattering amplitudes of photons and gravitons in the real world.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Constraints on Large-Scale White Noise in the Cosmic Density Field

We present observational constraints on large-scale white noise (LSWN) in the cosmic density field, a phenomenon predicted to arise from non-linear mode coupling during cosmological evolution. Building on the theoretical framework of Paper I, where we demonstrated that non-linearities inevitably redistribute power from small to large scales through mode mixing, we confront these predictions with current cosmological data. We modify the CLASS Boltzmann code to incorporate a white noise component $k_\mathrm{BH}/k$ in the primordial power spectrum and perform parameter estimation using current cosmological data. The non-detection of excess power on the largest observable scales places stringent upper bounds: $k_\mathrm{BH} \leq 1.80 \times 10^{-13}~\mathrm{Mpc}^{-1}$ at 99% confidence. These constraints imply the primordial power spectrum must deviate from perfect scale invariance on small scales, either through a cutoff at $k_{\mathrm{cut}} \lesssim 3~\mathrm{pc}^{-1}$ or through running of the spectral index with $α_s \lesssim -0.015$. Our results demonstrate that LSWN provides a powerful probe of the primordial spectrum at scales orders of magnitude smaller than directly observable, offering unique constraints on early-universe physics.

Barenboim, Gabriela [Valencia U., IFIC; Valencia U↗

Simultaneous shape and topology optimization of inflatable soft robots

Simultaneous shape and topology optimization is used to design pressure-activated inflatable soft robots. The pressure loaded boundary is meshed conformingly and shape optimized, while the morphology of the robot is topology optimized. The design objective is to exert maximum force on an object, i.e. to produce soft “grippers”. The robot’s motion is modeled using nearly incompressible finite deformation hyperelasticity. To ensure stability of the robot, the buckling load factors obtained via linearized buckling analyses are constrained. The finite element method is used to evaluate the optimization cost and constraint functions and the adjoint method is employed to compute their sensitivities. The numerical examples produce pressure-driven soft robots with varying complexity. We also compare our simultaneous optimization results to those obtained via sequential topology and then shape optimization.

42 ENGINEERING↗

Improving initialization and evolution accuracy of cosmological neutrino simulations

Neutrino mass constraints are a primary focus of current and future large-scale structure (LSS) surveys. Non-linear LSS models rely heavily on cosmological simulations — the impact of massive neutrinos should therefore be included in these simulations in a realistic, computationally tractable, and controlled manner. Here, a recent proposal to reduce the related computational cost employs a symmetric neutrino momentum sampling strategy in the initial conditions. We implement a modified version of this strategy into the Hardware/Hybrid Accelerated Cosmology Code (HACC) and perform convergence tests on its internal parameters. We illustrate that this method can impart Script $\mathcal{O}$(1%) numerical artifacts on the total matter field on small scales, similar to previous findings, and present a method to remove these artifacts using Fourier-space filtering of the neutrino density field. Moreover, we show that the converged neutrino power spectrum does not follow linear theory predictions on relatively large scales at early times at the 15% level, prompting a more careful study of systematics in particle-based neutrino simulations. We also present an improved method for backscaling linear transfer functions for initial conditions in massive neutrino cosmologies that is based on achieving the same relative neutrino growth as computed with Boltzmann solvers. Our self-consistent backscaling method yields sub-percent accuracy in the total matter growth function. Comparisons for the non-linear power spectrum with the Mira-Titan emulator at a neutrino mass of m ν = 0.15 eV are in very good agreement with the expected level of errors in the emulator and in the direct N-body simulation.

79 ASTRONOMY AND ASTROPHYSICS↗

Towards Improving luminosity using optics tuning and data-driven methods

The results of Run 24 experiments at Relativistic Heavy Ion Collider (RHIC) for improving luminosity using optics tuning are presented in this study. In the first experiment, MADx matching was used to output magnet strengths corresponding to specific s star movements around Interaction Region 8 (IR8). The corresponding Zero Degree Calorimeter (ZDC) signal was measured in place of luminosity, and Bayesian Optimization aids search of optimal movements. It was found that values retrieved from matching were inaccurate, resulting in negative feedback loops. The second experiment focused on calculating accurate s star movements. The matching method was replaced with a linear sensitivity matrix, directly relating optics to power supply, and its null space was used to fit constraints such as hysteresis effects. At the experiment, beam losses were observed at collimators around boundary of IR8, which were fixed for the third experiment. Dynamic mode decomposition was also introduced to improve quality of turn-by-turn (TBT) data as well as accuracy and consistency of optics measurements at IR8. These improvements will be tested in the experiment of next RHIC run for luminosity optimization.

Accelerator Physics↗

Examining the Net Revenue and Downstream Flow Impact Trade-Offs for a Network of Cascading, Small-Scale Hydropower Facilities: Preprint

In this work, we used a price-taker model to investigate the trade-offs between net revenue and downstream flow impacts for a network of small, cascading hydro facilities. The network consisted of 36 facilities, each with a small amount of local storage (between 2 and 45 minutes). Generator sizes ranged between 0.5 and 1 MW, nominal, and the total capacity of the network was 33.5 MW. We used a multi-integer linear programing model to maximize the net revenue of the combined network subject to operating and environmental constraints. Net revenue optimizations relied on historic price data, and dry, typical, and wet years were studied to help ensure robustness. Energy and ancillary service sales were included in the net revenue calculations, and both unit commitment and dispatch simulations were performed. We found that limiting the downstream flows to ±50% of the river’s natural flows had a negligible impact on net revenues (<1% reduction), irrespective of hydrologic conditions, and even when downstream flows were limited to ±5%, net revenues were only impacted by 4%. These outcomes are significant because they demonstrate how an array of small-scale hydropower facilities can be operated to have minimal impact on natural stream flows—addressing a critical environmental concern.

downstream flow↗

Time-dependent relaxed magnetohydrodynamics: Inclusion of cross helicity constraint using phase-space action

In this work, a phase-space version of the ideal magnetohydrodynamic (MHD) Lagrangian is derived from first principles and shown to give a relabeling transformation when a cross-helicity constraint is added in Hamilton's Action Principle. A new formulation of time-dependent “relaxed” magnetohydrodynamics is derived using microscopic conservation of mass and macroscopic constraints on total magnetic helicity, cross helicity, and entropy under variations of density, pressure, fluid velocity, and magnetic vector potential. This gives Euler–Lagrange equations consistent with previous work on both ideal and relaxed MHD equilibria with flow, but generalizes the relaxation concept from statics to dynamics. The application of the new dynamical formalism is illustrated for short-wavelength linear waves, and the interface connection conditions for Multiregion Relaxed MHD (MRxMHD) are derived. The issue of whether E+u×B=0 should be a constraint is discussed.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Fuzzy dark matter and the Dark Energy Survey Year 1 data

ABSTRACT Gravitational weak lensing by dark matter haloes leads to a measurable imprint in the shear correlation function of galaxies. Fuzzy dark matter (FDM), composed of ultralight axion-like particles of mass m ∼ 10−22 eV, suppresses the matter power spectrum and shear correlation with respect to standard cold dark matter. We model the effect of FDM on cosmic shear using the optimized halo model HMCode, accounting for additional suppression of the mass function and halo concentration in FDM as observed in N-body simulations. We combine Dark Energy Survey Year 1 (DES-Y1) data with the Planck cosmic microwave background anisotropies to search for shear correlation suppression caused by FDM. We find no evidence of suppression compared to the preferred cold dark matter model, and thus set a new lower limit to the FDM particle mass. Using a log-flat prior and marginalizing over uncertainties related to the non-linear model of FDM, we find a new, independent 95 per cent C.L. lower limit log10m > −23 combining Planck and DES-Y1 shear, an improvement of almost two orders of magnitude on the mass bound relative to CMB-only constraints. Our analysis is largely independent of baryonic modelling, and of previous limits to FDM covering this mass range. Our analysis highlights the most important aspects of the FDM non-linear model for future investigation. The limit to FDM from weak lensing could be improved by up to three orders of magnitude with $\mathcal {O}(0.1)$ arcmin cosmic shear angular resolution, if FDM and baryonic feedback can be simultaneously modelled to high precision in the halo model.

79 ASTRONOMY AND ASTROPHYSICS↗

Estimating basis functions in massive fields under the spatial mixed effects model

Abstract Spatial prediction is commonly achieved under the assumption of a Gaussian random field by obtaining maximum likelihood estimates of parameters, and then using the kriging equations to arrive at predicted values. For massive datasets, fixed rank kriging using the expectation–maximization algorithm for estimation has been proposed as an alternative to the usual but computationally prohibitive kriging method. The method reduces computation cost of estimation by redefining the spatial process as a linear combination of basis functions and spatial random effects. A disadvantage of this method is that it imposes constraints on the relationship between the observed locations and the knots. We develop an alternative method that utilizes the spatial mixed effects model, but allows for additional flexibility by estimating the range of the spatial dependence between the observations and the knots via an alternating expectation conditional maximization algorithm. Experiments show that our methodology improves estimation without sacrificing prediction accuracy while also minimizing the additional computational burden of extra parameter estimation. The methodology is applied to a temperature dataset archived by the United States National Climate Data Center, with improved results over previous methodology.

Pazdernik, Karl↗

Hydropower flexibility valuation tool for flow requirement evaluation

Timing of generation is becoming more and more valuable. This creates greater potential tension between environmental and power system objectives since both systems require their own flow patterns. Identifying win–win outcomes in this context requires being able to discuss the value of flexibility across stakeholder groups. This research proposes a two-stage optimization method to understand hydropower flexibility to meet both environmental and power system requirements. The tool simulates the two-settlement market process in the U.S. by maximizing revenues from both the day-ahead and real-time markets, subject to plant operational limits, regulatory flow and ramping requirements, and uncertainties associated with water availability and market prices. The model is formulated as linear programming problems and solved using IBM ILOG CPLEX optimizer. By examining a range of flow requirements, ramping constraints, and storage capacities, the proposed tool shows how to make more informed decisions to weigh the cost of specific flow requirements in the context of the overall license requirements. Results from the case study show that revenue is more sensitive to the ramping constraints than the minimum flow constraints. We also demonstrate that removing flow constraints in a dry month increases monthly revenue by up to 118%, as opposed to only 1% in a wet month. In addition, our results suggest that using a learning-based water flow forecast results in an increase of monthly revenue up to 6.4% compared with persistence forecast.

13 HYDRO ENERGY↗

An Incremental Gradient Method for Optimization Problems With Variational Inequality Constraints

We consider minimizing a sum of agent-specific nondifferentiable merely convex functions over the solution set of a variational inequality (VI) problem in that each agent is associated with a local monotone mapping. This problem finds an application in computation of the best equilibrium in nonlinear complementarity problems arising in transportation networks. We develop an iteratively regularized incremental gradient method where at each iteration, agents communicate over a directed cycle graph to update their solution iterates using their local information about the objective and the mapping. The proposed method is single-timescale in the sense that it does not involve any excessive hard-to-project computation per iteration. We derive nonasymptotic agent-wise convergence rates for the suboptimality of the global objective function and infeasibility of the VI constraints measured by a suitably defined dual gap function. Finally, the proposed method appears to be the first fully iterative scheme equipped with iteration complexity that can address distributed optimization problems with VI constraints over cycle graphs.

convergence↗

Multi-Fidelity Stochastic Economic Dispatch for Operating Low Carbon Power Grids

Grid operators can address the inherently stochastic nature of renewables by solving a two-stage stochastic programming model that minimizes the cost of dispatch decisions while accounting for the complex grid dynamics. It is common to use a sample average approximation to estimate the expectation of the second stage costs in this model. However, the large sample count needed for numerical accuracy makes effective modeling large-scale electric grids computationally intractable. We introduce a control variate multi-fidelity estimator for the second-stage recourse that enables high quality dispatch decisions in real-time with a reduced computational burden. We obtain a hierarchy of model fidelities by linearizing the AC power flow system representation to DC power flow, and by relaxing transmission and voltage network constraints. We evaluate the performance of our proposed method on a synthetic grid with 73 buses against a deterministic baseline with persistence forecast and a high-fidelity reference. Our analysis shows a computational speed-up of 7.62x with a minimal loss in accuracy. The multi-fidelity method is well suited to fidelity combinations that use a simplified network topology in their lower fidelity model and is an attractive option for applications where accurate grid modeling needed on a limited computational budget.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Automating Discovery of Physics-Informed Neural State Space Models via Learning and Evolution

Recent works exploring deep learning application to dynamical systems modeling have demonstrated that embedding physical priors into neural networks can yield more effective, physically-realistic, and data-efficient models. However, in the absence of complete prior knowledge of a dynamical system's physical characteristics, determining the optimal structure and optimization strategy for these models can be difficult. In this work, we explore methods for discovering neural state space dynamics models for system identification. Starting with a design space of block-oriented state space models and structured linear maps with strong physical priors, we encode these components into a model genome alongside network structure, penalty constraints, and optimization hyperparameters. Demonstrating the overall utility of the design space, we employ an asynchronous genetic search algorithm that alternates between model selection and optimization and obtains accurate physically consistent models of three physical systems: an aerodynamics body, a continuous stirred tank reactor, and a two tank interacting system.

genetic algorithms, neural architecture search, ne↗

Towards a self-consistent analysis of the anisotropic galaxy two- and three-point correlation functions on large scales: application to mock galaxy catalogues

We establish a practical method for the joint analysis of anisotropic galaxy two- and three-point correlation functions (2PCF and 3PCF, respectively) on the basis of the decomposition formalism of the 3PCF using tripolar spherical harmonics. We perform such an analysis with MultiDark-Patchy mock catalogues to demonstrate and understand the benefit of the anisotropic 3PCF. We focus on scales above $80\, h^{-1}\, {\rm Mpc}$, and use information from the shape and the baryon acoustic oscillation (BAO) signals of the 2PCF and 3PCF. We also apply density field reconstruction to increase the signal-to-noise ratio of BAO in the 2PCF measurement, but not in the 3PCF measurement. In particular, we study in detail the constraints on the angular diameter distance and the Hubble parameter. We build a model of the bispectrum or 3PCF that includes the non-linear damping of the BAO signal in redshift space. We carefully account for various uncertainties in our analysis including theoretical models of the 3PCF, window function corrections, biases in estimated parameters from the fiducial values, the number of mock realizations to estimate the covariance matrix, and bin size. The joint analysis of the 2PCF and 3PCF monopole and quadrupole components shows a $30{{\ \rm per\ cent}}$ and $20{{\ \rm per\ cent}}$ improvement in Hubble parameter constraints before and after reconstruction of the 2PCF measurements, respectively, compared to the 2PCF analysis alone. Furthermore, this study clearly shows that the anisotropic 3PCF increases cosmological information from galaxy surveys and encourages further development of the modelling of the 3PCF on smaller scales than we consider.

79 ASTRONOMY AND ASTROPHYSICS↗

Effective data sampling strategies and boundary condition constraints of physics-informed neural networks for identifying material properties in solid mechanics

Material identification is critical for understanding the relationship between mechanical properties and the associated mechanical functions. However, material identification is a challenging task, especially when the characteristic of the material is highly nonlinear in nature, as is common in biological tissue. In this work, we identify unknown material properties in continuum solid mechanics via physics-informed neural networks (PINNs). To improve the accuracy and efficiency of PINNs, we develop efficient strategies to nonuniformly sample observational data. We also investigate different approaches to enforce Dirichlet-type boundary conditions (BCs) as soft or hard constraints. Finally, we apply the proposed methods to a diverse set of time-dependent and time-independent solid mechanic examples that span linear elastic and hyperelastic material space. The estimated material parameters achieve relative errors of less than 1%. As such, this work is relevant to diverse applications, including optimizing structural integrity and developing novel materials.

97 MATHEMATICS AND COMPUTING↗

Non-linear elastic-plastic behavior of the invert glass lithium phosphorous oxynitride (LiPON)

Micro and nano-scale mechanical behavior of network/ionic glasses is dictated by their composition and the number of constraints per structural unit. From this perspective, the glass LiPON presents the opportunity for enhancement of the microscale ductility due to its rather unconstrained orthophosphate structure. Here, we use instrumented nanoindentation with different tip geometries to investigate the mechanical response of LiPON glass. The results reveal that the elastic modulus of LiPON is not constant and depends on pressure. With the method utilizing spherical nanoindentation and continuous stiffness measurement (CSM) we determine the yield point of LiPON. We propose the Drucker-Prager type of yield criterion for LiPON and estimate its yield stress in compression as 2.4 GPa. There exists another stress threshold, however, around 490 MPa, at which the elastic deformation becomes non-linear, and this can be mistaken for the yield stress.

Constitutive model↗