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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 469 records · Page 26

Real-time POD-CFD Wind-Load Calculator for PV Systems

The primary objective of this project is to create an accurate web-based real-time wind-load calculator. This is of paramount importance for (1) the rapid and accurate assessments of the uplift and downforce loads on a PV mounting system, (2) identifying viable solutions from available mounting systems, and therefore helping reduce the cost of mounting hardware and installation. Wind loading calculations for structures are currently performed according to the American Society of Civil Engineers/ Structural Engineering Institute Standard ASCE/SEI 7; the values in this standard were calculated from simplified models that do not necessarily take into account relevant characteristics such as those from full 3D effects, end effects, turbulence generation and dissipation, as well as minor effects derived from shear forces on installation brackets and other accessories. This standard does not include provisions that address the special requirements of rooftop PV systems, and attempts to apply this standard may lead to significant design errors as wind loads are incorrectly estimated. Therefore, an accurate calculator would be of paramount importance for the preliminary assessments of the uplift and downforce loads on a PV mounting system, identifying viable solutions from available mounting systems, and therefore helping reduce the cost of the mounting system and installation. The challenge is that although a full-fledged three-dimensional computational fluid dynamics (CFD) analysis would properly and accurately capture the complete physical effects of air flow over PV systems, it would be impractical for this tool, which is intended to be a real-time web-based calculator. CFD routinely requires enormous computation times to arrive at solutions that can be deemed accurate and grid-independent even in powerful and massively parallel computer platforms.

14 SOLAR ENERGY↗

Systems Engineering Building Advances Power Grid Research

Researchers and industry are now better equipped to tackle the nation’s most pressing energy challenges through PNNL’s new Systems Engineering Building – including challenges in grid modernization, buildings efficiency and renewable energy integration. This lab links real-time grid data, software platforms, specialized laboratories and advanced computing resources for the design and demonstration of new tools to modernize the grid and increase buildings energy efficiency.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

A hyper-spherical adaptive sparse-grid method for high-dimensional discontinuity detection

This work proposes and analyzes a hyper-spherical adaptive hierarchical sparse-grid method for detecting jump discontinuities of functions in high-dimensional spaces is proposed. The method is motivated by the theoretical and computational inefficiencies of well-known adaptive sparse-grid methods for discontinuity detection. Our novel approach constructs a function representation of the discontinuity hyper-surface of an N-dimensional dis- continuous quantity of interest, by virtue of a hyper-spherical transformation. Then, a sparse-grid approximation of the transformed function is built in the hyper-spherical coordinate system, whose value at each point is estimated by solving a one-dimensional discontinuity detection problem. Due to the smoothness of the hyper-surface, the new technique can identify jump discontinuities with significantly reduced computational cost, compared to existing methods. Moreover, hierarchical acceleration techniques are also incorporated to further reduce the overall complexity. Rigorous error estimates and complexity analyses of the new method are provided as are several numerical examples that illustrate the effectiveness of the approach.

97 MATHEMATICS AND COMPUTING↗

A method of alternating characteristics with application to advection-dominated environmental systems

We present a numerical method for solving a class of systems of partial differential equations (PDEs) that arises in modeling environmental processes undergoing advection and biogeochemical reactions. The salient feature of these PDEs is that all partial derivatives appear in linear expressions. As a result, the system can be viewed as a set of ordinary differential equations (ODEs), albeit each one along a different characteristic. The method then consists of alternating between equations and integrating each one step-wise along its own characteristic, thus creating a customized grid on which solutions are computed. Since the solutions of such PDEs are generally smoother along their characteristics, the method offers the potential of using larger time steps while maintaining accuracy and reducing numerical dispersion. The advantages in efficiency and accuracy of the proposed method are demonstrated in two illustrative examples that simulate depth-resolved reactive transport and soil carbon cycling.

54 ENVIRONMENTAL SCIENCES↗

Compact finite difference relaxation method for chaotic and hyperchaotic initial value systems

In this paper, we present a new application of higher order compact finite differences to solve nonlinear initial value problems exhibiting chaotic behaviour. The method involves dividing the domain of the problem into multiple sub-domains, with each sub-domain integrated using higher order compact finite difference schemes. The nonlinearity is dealt using a Gauss–Seidel-like relaxation. The method is, therefore, referred to as the multi-domain compact finite difference relaxation method (MD-CFDRM). In this new application, the MD-CFDRM is used to solve famous chaotic systems and hyperchaotic systems. The main advantage of the new approach is that it offers better accuracy on coarser grids which significantly improves the computational speed of the method. The results are compared with spectral-based multi-domain method.

97 MATHEMATICS AND COMPUTING↗

Field Dislocation Mechanics for heterogeneous elastic materials: A numerical spectral approach

Spectral methods using Fast Fourier Transform (FFT) algorithms have recently seen a surge in interest in the mechanics of materials community. The present work addresses the critical question of determining accurate local mechanical fields using FFT methods without artificial fluctuations arising from materials and defects induced discontinuities. Precisely, this work introduces a numerical approach based on intrinsic discrete Fourier transforms for the simultaneous treatment of material discontinuities arising from the presence of dislocations and from elastic stiffness heterogeneities. To this end, the elasto-static equations of the field dislocation mechanics theory for periodic heterogeneous materials are numerically solved with FFT in the case of dislocations in proximity of inclusions of varying stiffness. An optimal intrinsic discrete Fourier transform method is sought based on two distinct schemes. A centered finite difference scheme for differential rules are used for numerically solving the Poisson-type equation in the Fourier space, while centered finite differences on a rotated grid is chosen for the computation of the modified Fourier–Green’s operator associated with the Lippmann–Schwinger-type equation. By comparing different methods with analytical solutions for an edge dislocation in a composite material, it is found that the present spectral method is accurate, devoid of any numerical oscillation, and efficient even for an infinite phase elastic contrast like a hole embedded in a matrix containing a dislocation. The present FFT method is then used to simulate physical cases such as the elastic fields of dislocation dipoles located near the matrix/inclusion interface in a 2D composite material and the ones due to dislocation loop distributions surrounding cubic inclusions in 3D composite material. In these configurations, the spectral method allows investigating accurately the elastic interactions and image stresses due to dislocation fields in the presence of elastic inhomogeneities.

36 MATERIALS SCIENCE↗

End-To-End Decentralized Transmission Line Protection in IBR-Dominated Weak Grids Using Interpretable Data-Driven Methods

Traditional transmission line protection relies on predictable synchronous-based fault signatures, which frequently fail under the non-standard, current-limited fault characteristics of Inverter-Based Resources (IBRs). This study investigates how to achieve secure, communication-free fault isolation in IBR-dominated weak grids without relying on opaque, computationally heavy "black-box" machine learning algorithms. To address this, we propose a novel, standalone, and inherently interpretable data-driven protection framework. Unlike centralized methods requiring multi-terminal communication, this decentralized approach relies solely on local measurements using a hierarchical linear-kernel Support Vector Machine (SVM). The methodology decomposes the protection task into four sequential stages that mimic traditional protection elements: fault detection and fault direction identification, fault type classification, zone classification, and location estimation. This multi-stage architecture allows for specialized feature engineering at each stage, combining high computational efficiency with logic traceability. The framework's end-to-end performance was validated via C-code and PSCAD/EMTDC co-simulation, utilizing a real-world utility network and an OEM black-box IBR model. The proposed relay achieves 97.2% overall accuracy and provides a reliable trip decision within a 2.5-cycle window. The results confirm 100% accuracy in fundamental fault detection, reliable zone selectivity across low to moderate fault resistances, and robust security against non-fault transients, proving its immediate viability for integration into commercial numerical relays.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Simulations of divertor designs that spatially separate power and particle exhaust using mid-leg divertor particle pumping

Predictive design modeling of a Dissipation-Focused Divertor for future operation in DIII-D reveals that increasing the poloidal distance of the pump duct entrance from the target surface along the low-field side divertor baffle increases neutral compression and modifies the spatial distribution of power dissipation. With a divertor pump located mid-leg between the target and the X-point, SOLPS-ITER boundary plasma simulations without drifts predict the formation of a dense neutral cloud near the target with > 30x higher neutral compression in detachment, a more stable detachment front located further from the target, and ~25% lower outer midplane separatrix density required for detachment onset, compared to a pump located in the scrape-off layer at the target surface. Up to 19 MW of power flowing into the divertors is modeled using the following two numerical implementations for particle pumping: a specified fraction of particles incident on variable wall sections of the plasma grid is removed from the computational domain (so-called albedo pumping), and a pump duct is modeled which includes dynamics of kinetic neutrals in the duct. The simulations show that the detachment front is located between the divertor target and the X-point and is relatively stable near the pump entrance, without a strong dependence on gas puff rate or injected power. The mid-leg pump design spatially separates the two primary functions of a divertor (power handling and particle exhaust), with the majority of power dissipation occurring near the target plate and particle exhaust taking place further upstream. The benefit of enhanced dissipation using mid-leg pumping comes at the cost of a higher outer midplane separatrix density for a given amount of particle injection.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

2D modeling of electromagnetic waves in cold plasmas

The consequences of sheath (rectified) electric fields, resulting from the different mobility of electrons and ions as a response to radio frequency (RF) fields, are a concern for RF antenna design as it can cause damage to antenna parts, limiters and other in-vessel components. As a first step to a more complete description, the usual cold plasma dielectric description has been adopted, and the density profile was assumed to be known as input. Ultimately, the relevant equations describing the wave-particle interaction both on the fast and slow timescale will need to be tackled but prior to doing so was felt as a necessity to get a feeling of the wave dynamics involved. Maxwell's equations are solved for a cold plasma in a 2D antenna box with strongly varying density profiles crossing also lower hybrid and ion-ion hybrid resonance layers. Numerical modelling quickly becomes demanding on computer power, since a fine grid spacing is required to capture the small wavelengths effects of strongly evanescent modes.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Effect of impurity doping on tunneling conductance in AB-stacked bi-layer graphene: A tight-binding study

We report here a microscopic tight-binding model calculation for AB-stacked bilayer graphene in presence of biasing potential between the two layers and the impurity effects to study the evolution of the total density of states with special emphasis on opening of band gap near Dirac point. We have calculated the electron Green’s functions for both the A and B sub-lattices by Zubarev technique. The imaginary part of the Green’s function gives the partial and total density of states of electrons. The density of states are computed numerically for 1000 × 1000 grid points of the electron momentum. The evolution of the opening of band gap near van-Hove singularities as well as near Dirac point is investigated by varying the different interlayer hoppings and the biasing potentials. The inter layer hopping splits the density of states at van-Hove singularities and produces a V-shaped gap near Dirac point. Further the biasing potential introduces a U shaped gap near Dirac point with a density minimum at the applied potential(i.e. at V/2).

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Emulating climate extreme indices

We use simple pattern scaling and time-shift to emulate changes in a set of climate extreme indices under future scenarios, and evaluate the emulators' accuracy. We propose a metric for the error in emulation in the context of initial condition ensembles, to specifically characterize the role of internal variability in the emulation performance. Our metric separates systematic emulation errors from unavoidable discrepancies between emulated and target values due to internal variability. We compute the metricis at grid-point scale, and we show geographically resolved results, or aggregate them at global scale. We demonstrate the use of our error metric in the emulation of a suite of temperature and precipitation extreme indices. We test and compare simple pattern scaling and time-shift using a range of trajectories spanning targets inspired by the Paris agreement -- warming to 1.5C and 2.0C from the pre-industrial baseline -- and two of the longer-established trajectories, RCP4.5 and RCP8.5. With this suite of scenarios we can test the effects on the performance of the size of the temperature gap between emulation origin and target. We find that for most indices emulation the dominant source of discrepancy is internal variability. For at least one index, however, counting exceedances of a high temperature threshold, significant portions of the globally aggregated discrepancy and its regional pattern originate from the systematic emulation error. This error exceeds internal variability of both the target and the emulated quantities in large coherent regions at low latitudes, and the explanation can be found in the differential behavior of temperature distributions across latitudes. The metric also highlights a fundamental difference in the two methods related to the simulation of internal variability, which is dampened significantly by simple pattern scaling. This aspect is of consequence when using these methods for specific applications, where preserving variability for uncertainty quantification is deemed important. With this study we offer our metric as a diagnostic tool, facilitating the formulation of scientific hypotheses on the reasons for the error. In the meantime, we show that for many impact relevant indices by now traditional emulation techniques can be accurate within the variations unavoidably introduced by internal variability, establishing the fundamental condition for using their emulation in impact modeling.

54 ENVIRONMENTAL SCIENCES↗

Computing the Feasible Spaces of Optimal Power Flow Problems

The solution to an optimal power flow (OPF) problem provides a minimum cost operating point for an electric power system. The performance of OPF solution techniques strongly depends on the problem’s feasible space. This paper presents an algorithm that is guaranteed to compute the entire feasible spaces of small OPF problems to within a specified discretization tolerance. Specifically, the feasible space is computed by discretizing certain of the OPF problem’s inequality constraints to obtain a set of power flow equations. All solutions to the power flow equations at each discretization point are obtained using the Numerical Polynomial Homotopy Continuation (NPHC) algorithm. To improve computational tractability, “bound tightening” and “grid pruning” algorithms use convex relaxations to preclude consideration of many discretization points that are infeasible for the OPF problem. Here, the proposed algorithm is used to generate the feasible spaces of two small test cases.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Distributed Resources for the Earth System Grid Advanced Management (DREAM)

The DREAM project was funded more than 3 years ago to design and implement a next-generation ESGF (Earth System Grid Federation) architecture which would be suitable for managing and accessing data and services resources on a distributed and scalable environment. In particular, the project intended to focus on the computing and visualization capabilities of the stack, which at the time were rather primitive. At the beginning, the team had the general notion that a better ESGF architecture could be built by modularizing each component, and redefining its interaction with other components by defining and exposing a well defined API. Although this was still the high level principle that guided the work, the DREAM project was able to accomplish its goals by leveraging new practices in IT that started just about 3 or 4 years ago: the advent of containerization technologies (specifically, Docker), the development of frameworks to manage containers at scale (Docker Swarm and Kubernetes), and their application to the commercial Cloud. Thanks to these new technologies, DREAM was able to improve the ESGF architecture (including its computing and visualization services) to a level of deployability and scalability beyond the original expectations. Overall, during its three-year lifespan, DREAM has undertaken innovative research work and prototyping: many of its solutions (the new containerized architecture, the Visus visualization engine, the Solr Cloud based search service) were handed over to the ESGF collaboration, which will make them operational and use them as their future software basis.

42 ENGINEERING↗

VPP Cybersecurity: Stakeholder Roles and Responsibilities

This presentation was presented at the Aggregation and Grid Security Workshop - held on June 17-18, 2025, at NREL in Golden, Colorado. The goal of the two-day workshop was to address the critical cybersecurity challenges for the future electric grid. This presentation outlines a framework for assessing the roles and responsibilities of virtual power plant stakeholders in mitigating cyber risk to virtual power plant projects and the overall power grid.

24 POWER TRANSMISSION AND DISTRIBUTION↗

ESTIMATING THE RADIUS OF THE CONVECTIVE CORE OF MAIN-SEQUENCE STARS FROM OBSERVED OSCILLATION FREQUENCIES

The determination of the size of the convective core of main-sequence stars is usually dependent on the construction of models of stars. Here we introduce a method to estimate the radius of the convective core of main-sequence stars with masses between about 1.1 and 1.5 M {sub ⊙} from observed frequencies of low-degree p -modes. A formula is proposed to achieve the estimation. The values of the radius of the convective core of four known stars are successfully estimated by the formula. The radius of the convective core of KIC 9812850 estimated by the formula is 0.140 ± 0.028 R {sub ⊙}. In order to confirm this prediction, a grid of evolutionary models was computed. The value of the convective-core radius of the best-fit model of KIC 9812850 is 0.149 R {sub ⊙}, which is in good agreement with that estimated by the formula from observed frequencies. The formula aids in understanding the interior structure of stars directly from observed frequencies. The understanding is not dependent on the construction of models.

79 ASTRONOMY AND ASTROPHYSICS↗

Evaluation of autoconversion and accretion enhancement factors in general circulation model warm-rain parameterizations using ground-based measurements over the Azores

A great challenge in climate modeling is how to parameterize subgrid cloud processes, such as autoconversion and accretion in warm-rain formation. In this study, we use ground-based observations and retrievals over the Azores to investigate the so-called enhancement factors, E auto and E accr , which are often used in climate models to account for the influence of subgrid variance of cloud and precipitation water on the autoconversion and accretion processes. E auto and E accr are computed for different equivalent model grid sizes. The calculated E auto values increase from 1.96 (30 km) to 3.2 (180 km), and the calculated E accr values increase from 1.53 (30 km) to 1.76 (180 km). Comparing the prescribed enhancement factors in Morrison and Gettleman (2008, MG08) to the observed ones, we found that a higher E auto (3.2) at small grids and lower E accr (1.07) are used in MG08, which might explain why most of the general circulation models (GCMs) produce too-frequent precipitation events but with too-light precipitation intensity. The ratios of the rain to cloud water mixing ratio ( q r / q c ) at E accr =1.07 and E accr =2.0 are 0.063 and 0.142, respectively, from observations, further suggesting that the prescribed value of E accr =1.07 used in MG08 is too small to simulate precipitation intensity correctly. Both E auto and E accr increase when the boundary layer becomes less stable, and the values are larger in precipitating clouds ( CLWP>75 gm -2 ) than those in non-precipitating clouds ( CLWP<75 gm -2 ). Therefore, the selection of E auto and E accr values in GCMs should be regime- and resolution-dependent.

54 ENVIRONMENTAL SCIENCES↗

PIMS: A Lightweight Processing-in-Memory Accelerator for Stencil Computations

Stencil computation is a classic computational kernel present in many high-performance scientific applications, like image process- ing and partial differential equation solvers (PDE). A stencil compu- tation sweeps over a multi-dimensional grid and repeatedly updates values associated with points using the values from neighboring points. Stencil computations often employ large datasets that ex- ceed cache capacity, leading to excessive accesses to the memory subsystem. As such, 3D stencil computations on large grid sizes are memory-bound. In this paper we present PIMS, an in-memory accelerator for stencil computations. PIMS, implemented in the logic layer of a 3D- stacked memory, exploits the high bandwidth provided by through- silicon vias to reduce redundant memory traffic. Our comprehensive evaluation using three different grid sizes with six categories of orders indicate that the proposed architecture reduces 48.25% of data movement on average and obtains up to 65.55% of bank conflict reduction.

Li, Jie↗

A new hybrid-Lagrangian numerical scheme for gyrokinetic simulation of tokamak edge plasma

In order to enable kinetic simulation of non-thermal edge plasmas at a reduced computational cost, a new hybrid-Lagrangian δf scheme has been developed that utilizes the phase space grid in addition to the usual marker particles, taking advantage of the computational strengths from both sides. The new scheme splits the particle distribution function of a kinetic equation into two parts. Marker particles contain the fast space-time varying, δf, part of the distribution function and the coarse-grained phase-space grid contains the slow space-time varying part. The coarse-grained phase-space grid reduces the memory-requirement and the computing cost, while the marker particles provide scalable computing ability for the fine-grained physics. Weights of the marker particles are determined by a direct weight evolution equation instead of the differential form weight evolution equations that the conventional delta-f schemes use. The particle weight can be slowly transferred to the phase space grid, thereby reducing the growth of the particle weights. The non-Lagrangian part of the kinetic equation – e.g., collision operation, ionization, charge exchange, heat-source, radiative cooling, and others – can be operated directly on the phase space grid. Deviation of the particle distribution function on the velocity grid from a Maxwellian distribution function – driven by ionization, charge exchange and wall loss – is allowed to be arbitrarily large. The numerical scheme is implemented in the gyrokinetic particle code XGC1, which specializes in simulating the tokamak edge plasma that crosses the magnetic separatrix and is in contact with the material wall.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗