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Results for “integration of the source function”

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 199 records · Page 11
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Noncollinear ground states of solids with a source-free exchange correlation functional

In this paper, we expand upon the source-free (SF) exchange correlation (XC) functional developed by Sangeeta Sharma and coworkers to plane-wave density functional theory (DFT) based on the projector augmented wave (PAW) method. This constraint is implemented by the current authors within the VASP source code, using a fast Poisson solver that capitalizes on the parallel three-dimensional fast Fourier transforms (FFTs) implemented in VASP. Using this modified XC functional, we explore the improved convergence behavior that results from applying this constraint to the GGA-PBE+U+J functional. In the process, we compare the noncollinear magnetic ground state computed by each functional and their SF counterpart for a select number of magnetic materials in order to provide a metric for comparing with experimentally determined magnetic orderings. We observe significantly improved agreement with experimentally measured magnetic ground-state structures after applying the source-free constraint. Furthermore, we explore the importance of considering probability current densities in spin-polarized systems, even under no applied field. We analyze the XC torque as well, in order to provide theoretical and computational analyses of the net XC magnetic torque induced by the source-free constraint. Along these lines, we highlight the importance of properly considering the real-space integral of the source-free local magnetic XC field. Our analyses on probability currents, net torque, and constant terms draw additional links to the rich body of previous research on spin-current density functional theory (SCDFT), and pave the way for future extensions and corrections to the SF corrected XC functional.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Progress and roadmap for electro-privileged transformations of bio-derived molecules

Biomass incorporates carbon captured from the atmosphere and can serve as a renewable feedstock for producing valuable chemicals and fuels. Here we look at how electrochemical approaches can impact biomass valorization, focusing on identifying chemical transformations that leverage renewable electricity and feedstocks to produce valorized products via electro-privileged transformations. First, we recommend that the field should explore widening the spectrum of platform chemicals derived from bio-feedstocks, thus offering pathways to molecules that have historically been derived from petroleum. Second, we identify opportunities in electrocatalytic production of energy-dense fuels from biomass that utilize water as the hydrogen source and renewable electricity as the driving force. Finally, we look at the potential in electrochemical depolymerization to preserve key functional groups in raw feedstocks that would otherwise be lost during harsh pre-treatments in traditional depolymerization routes. Finally, on the basis of these priorities, we suggest a roadmap for the integration of biomass and electrochemistry and offer milestones required to tap further into the potential of electrochemical biomass valorization.

electrocatalysis↗
NASA NTRS1932

Calculation of potential flow past airship bodies in yaw

An outline of Von Karman's method of computing the potential flow of airships in yaw by means of partially constant dipolar superposition on the axis of the body is followed by several considerations for beginning and end of the superposition. Then this method is improved by postulating a continuous, in part linearly variable dipolar superposition on the axis. The second main part of the report brings the calculation of the potential flow by means of sources and sinks, arranged on the surface of the airship body. The integral equation which must satisfy this surface superposition is posed, and the core reduced to functions developed from whole elliptical normal integrals. The functions are shown diagrammatically. The integration is resolvable by iteration. The consequence of the method is good. The formulas for computing the velocity on the surface and of the potential for any point conclude the report.

Lotz, I↗
DOE OSTI2026

Fermilab PIP-II machine protection system digitized data noise elimination scheme and its FPGA implementation

In Fermilab's PIP-II machine protection system, beam loss signals from various detectors are digitized at 125 MS/s. Noise from both high-frequency sources and low-frequency 60 Hz AC power equipment can contaminate the data. To suppress noise across these ranges—especially 60 Hz and its harmonics, which overlap with beam loss signal frequencies—advanced digital processing beyond standard filtering is required. Several real-time functional blocks were simulated and tested on an FPGA: (1) a dual time-constant discharging integrator filter, (2) a de-ripple baseline extraction and storage block, and (3) a fast-recovery discharging integrator. The nonlinear IIR integrator filter removes high-frequency noise and feeds into the baseline extractor. Upon detecting abrupt beam loss, it switches to a longer time constant to prevent baseline distortion. The de-ripple block calculates a valid baseline by averaging over multiple 60 Hz periods, storing results in a 4096-word FPGA RAM. This baseline is subtracted from raw data before integration by the fast-recovery block, which resets quickly after use. All blocks achieved expected performance and were successfully implemented on a low-cost FPGA.

Wu, Jinyuan [Fermilab]↗
NASA NTRS2008

Overview of the Smart Network Element Architecture and Recent Innovations

In industrial environments, system operators rely on the availability and accuracy of sensors to monitor processes and detect failures of components and/or processes. The sensors must be networked in such a way that their data is reported to a central human interface, where operators are tasked with making real-time decisions based on the state of the sensors and the components that are being monitored. Incorporating health management functions at this central location aids the operator by automating the decision-making process to suggest, and sometimes perform, the action required by current operating conditions. Integrated Systems Health Management (ISHM) aims to incorporate data from many sources, including real-time and historical data and user input, and extract information and knowledge from that data to diagnose failures and predict future failures of the system. By distributing health management processing to lower levels of the architecture, there is less bandwidth required for ISHM, enhanced data fusion, make systems and processes more robust, and improved resolution for the detection and isolation of failures in a system, subsystem, component, or process. The Smart Network Element (SNE) has been developed at NASA Kennedy Space Center to perform intelligent functions at sensors and actuators' level in support of ISHM.

Perotti, Jose M.↗
NASA NTRS1984

Line transfer in static and expanding spherical atmospheres

The integral-operator method is extended to line and continuum transfer calculations for static and expanding spherical radiating atmospheres. A relationship is defined between radiative transfer and the source function at particular optical depths. Linearized equations are developed for the mean intensity, monochromatic scattering, line transfer, and line transfer with absorption. Numerical solutions are obtained for each equation, as well as for background absorption and scattering, partial redistribution when the line source is frequency dependent, and line transfer in connection with the expansion velocity. Finally, a solution is found for spherical expansion in concert with partial redistribution and Doppler line broadening.

Avrett, E. H.↗
NASA NTRS1993

A dual reciprocal boundary element formulation for viscous flows

The advantages inherent in the boundary element method (BEM) for potential flows are exploited to solve viscous flow problems. The trick is the introduction of a so-called dual reciprocal technique in which the convective terms are represented by a global function whose unknown coefficients are determined by collocation. The approach, which is necessarily iterative, converts the governing partial differential equations into integral equations via the distribution of fictitious sources or dipoles of unknown strength on the boundary. These integral equations consist of two parts. The first is a boundary integral term, whose kernel is the unknown strength of the fictitious sources and the fundamental solution of a convection-free flow problem. The second part is a domain integral term whose kernel is the convective portion of the governing PDEs. The domain integration can be transformed to the boundary by using the dual reciprocal (DR) concept. The resulting formulation is a pure boundary integral computational process.

Lafe, Olu↗
NASA NTRS1994

Constraints on the luminosity function of gamma-ray bursts detected by BATSE

We have utilized the integral moment analysis technique of Horack & Emslie to extract information on the allowable form of the luminosity function for gamma-ray bursts observed by Burst and Transient Source Experiment (BATSE). Using the general properties of moments, we are able to derive constraints on the range of luminosity from which the gamma-ray bursts must be sampled. These constraints are independent of the form of the radial distribution of the gamma-ray bursts, and depend only on the assumptions that space is Euclidean and that the luminosity function phi(L) is distance independent. For power-law luminosity functions of the form phi(L) = A(sub 0)L(exp -alpha), we find that the range of luminosity from which 80% of the gamma-ray bursts must be sampled cannot exceed approximately 6.5, with a 3 sigma upper limit of 12-15, regardless of the value of alpha.

Horack, J. M.↗
DOE OSTI2024

Development of online pulse-finding algorithms for the Mu2e Stopping Target Monitor and an evaluation of the signal to background ratio for the Mu2e stopped-muon rate determination

This thesis presents a determination of the acceptance of the Mu2e Stopping Target Monitor (STM) detector for both signal and background events. The rate of X-rays of a specific energy in the STM is used to determine the rate of stopped muons in the aluminium stopping target, which is used as the normalisation for all Mu2e measurements, particularly the branching ratio for a charged lepton flavour violating (cLFV) process. The acceptance for the 347\,keV $2p-1s$ aluminium signal X-ray is determined to be $(8.03 \pm 0.05) \times 10^{-10}$\,cm$^{-2}$ and the acceptance for the background photons (at 347\,keV) to be $(3.19 \pm 0.21) \times 10^{-8}$\,cm$^{-2}$. This results in a signal-to-background ratio of approximately two which is significantly higher than had previously been estimated. These signal-to-background rates are used to determine the time required to achieve a statistical uncertainty of 10\% on the number of 347\,keV X-rays as a function of the detector resolution and back ground rate. For a resolution of 2\,keV, and the background rate determined in this thesis, approximately one minute of data is required. The three corrections needed to be applied to the measured 347\,keV rate to determine the rate of stopped muons are also determined and potential sources of bias arising from the background shape, background fit range and energy calibration are investigated and found to be insignificant. The raw energy of the particles in the STM detector comes from a 16-bit ADC digitising at $\sim 300$\,MHz. It is not possible to store all the raw digitisations and online algorithms have been developed to rapidly select pulses in the detector and reconstruct their energy. The performance of these algorithms has been characterised with simulated data as a function of detector rate and resolution and optimum operating points for the algorithms have been defined. The integrity of the algorithms has also been demonstrated and characterised on test-beam data at high r ates and with radioactive sources at low rates.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

40 Ca transverse response function from coupled-cluster theory

Here, we present calculations of the 40 Ca transverse response function obtained from coupled-cluster theory used in conjunction with the Lorentz integral transform method. We employ nuclear forces derived at next-to-next-to leading order in chiral effective field theory with and without Δ degrees of freedom. We first benchmark this approach on the 4 He nucleus and compare both the transverse sum rule and the response function to earlier calculations based on different methods. As expected from the power counting of the chiral expansion of electromagnetic currents and from previous studies, our results retaining only one-body term underestimate the experimental data for 4 He by about 20%. However, when the method is applied to 40 Ca at the same order of the expansion, response functions do not lack strength and agree well with the world electron scattering data. We discuss various sources of theoretical uncertainties and comment on the comparison of our results with the available experiments.

39 ≤ A ≤ 58↗
DOE OSTI2020

Microgrid Power Flow Control with Integrated Battery Management Functions

This paper presents a microgrid power flow control for islanded microgrids consisting of photovoltaic (PV) system, battery energy storage system (BESS) and diesel generator. The proposed control ensures automatic coordination among the microgrid units. To achieve the coordination, the local control of PV system and BESS are configured to regulate power flow without relying on communications. The generator is controlled as the back-up source and its connection depends on battery state of charge (SOC). A state machine with hysteresis settings is used to trigger smooth transition among operation modes. Not only does the proposed controller consider battery SOC and power limits, but also integrates three-stage charging control as battery charging mechanism, which is not considered in the existing literature. The proposed control is validated for an islanded hybrid microgrid using an OPAL-RT real-time simulator.

Long, Qian↗
NASA NTRS1987

Radiative energy budget estimates for the 1979 southwest summer monsoon

A major objective of the summer monsoon experiment (SMONEX) was the determination of the heat sources and sinks associated with the southwest summer monsoon. The radiative component is presented here. The vertically integrated tropospheric radiation energy budget is negative and varies significantly as a function of monsoon activity. The gradient in the latitudinal mean tropospheric cooling reverses between the winter periods and the late spring/early summer periods. The radiative component of the vertical profile of the diabatic heating is derived. These profiles are a strong function of the stage of the monsoon as well as the geographic region. In general, the surface experiences a net gain of radiative energy during the late spring and early summer periods. During the winter periods, areas northward of 25 N display net surface losses, while the remaining areas exhibit net gains.

Ackerman, Steven A.↗
NASA NTRS1999

Design of a 2.5 Gbps Optical Transmitter for the International Space Station

A high data rate laser transmitter assembly (LTA) has been designed as the source for an optical free-space communication link between the International Space Station and the 1-meter Optical Communication Telescope Laboratory (OCTL) to be built at the Table Mountain Facility (IMF, Wrightwood, CA). The transmitter design concept uses a fiber-based master oscillator power amplifier (MOPA) configuration with an average output power of 200 made at a 1550 nm transmit wavelength. This transmitter source is also designed to provide a signal at 980 nm to the Silicon-based focal plane array for the point-ahead beam control function. This novel integration of a 980 nm boresight signal allows the use of Silicon based imagers for the acquisition/tracking and point-ahead functions, yet permits the transmit signal to be at any wavelength outside the Silicon sensitivity. The LTA, a sub-system of the Flight Terminal, has been designed to have a selectable data rate from 155 - 2500 Mbps in discrete steps. It also incorporates a 2.5 Gbps pseudo-random bit sequence (PRBS) generator for complete link testing and diagnostics. The design emphasizes using commercial off the shelf components (COTS).

Ortiz, Gerardo G.↗
NASA NTRS2008

Information Extraction for System-Software Safety Analysis: Calendar Year 2007 Year-End Report

This annual report describes work to integrate a set of tools to support early model-based analysis of failures and hazards due to system-software interactions. The tools perform and assist analysts in the following tasks: 1) extract model parts from text for architecture and safety/hazard models; 2) combine the parts with library information to develop the models for visualization and analysis; 3) perform graph analysis on the models to identify possible paths from hazard sources to vulnerable entities and functions, in nominal and anomalous system-software configurations; 4) perform discrete-time-based simulation on the models to investigate scenarios where these paths may play a role in failures and mishaps; and 5) identify resulting candidate scenarios for software integration testing. This paper describes new challenges in a NASA abort system case, and enhancements made to develop the integrated tool set.

Malin, Jane T.↗
DOE OSTI2020

Automated Integration of Continental-Scale Observations in Near-Real Time for Simulation and Analysis of Biosphere–Atmosphere Interactions

The National Ecological Observatory Network (NEON) is a continental-scale observatory with sites across the US collecting standardized ecological observations that will operate for multiple decades. To maximize the utility of NEON data, we envision edge computing systems that gather, calibrate, aggregate, and ingest measurements in an integrated fashion. Edge systems will employ machine learning methods to cross-calibrate, gap-fill and provision data in near-real time to the NEON Data Portal and to High Performance Computing (HPC) systems, running ensembles of Earth system models (ESMs) that assimilate the data. For the first time gridded EC data products and response functions promise to offset pervasive observational biases through evaluating, benchmarking, optimizing parameters, and training new machine learning parameterizations within ESMs all at the same model-grid scale. Leveraging open-source software for EC data analysis, we are already building software infrastructure for integration of near-real time data streams into the International Land Model Benchmarking (ILAMB) package for use by the wider research community. We will present a perspective on the design and integration of end-to-end infrastructure for data acquisition, edge computing, HPC simulation, analysis, and validation, where Artificial Intelligence (AI) approaches are used throughout the distributed workflow to improve accuracy and computational performance.

Durden, David J.↗
NASA NTRS2013

Sub-mm Scale Fiber Guided Deep/Vacuum Ultra-Violet Optical Source for Trapped Mercury Ion Clocks

We demonstrate the functionality of a mercury capillary lamp with a diameter in the sub-mm range and deep ultraviolet (DUV)/ vacuum ultraviolet (VUV) radiation delivery via an optical fiber integrated with the capillary. DUV spectrum control is observed by varying the fabrication parameters such as buffer gas type and pressure, capillary diameter, electrical resonator design, and temperature. We also show spectroscopic data of the 199Hg+ hyper-fine transition at 40.5GHz when applying the above fiber optical design. We present efforts toward micro-plasma generation in hollow-core photonic crystal fiber with related optical design and theoretical estimations. This new approach towards a more practical DUV optical interface could benefit trapped ion clock developments for future ultra-stable frequency reference and time-keeping applications.

lamps↗
DOE OSTI2023

Redox‐Functionalized Semiconductor Interfaces for Photoelectrochemical Separations

Redox-mediated electrosorption is a promising platform for selective electrochemical (EC) separations, due to its molecular selectivity, high uptake, and tunability for target ions. However, the electrical energy required is mainly generated by non-renewable energy sources, which limits its sustainability and overall impact to decarbonization. Here, a redox-mediated photoelectrochemical (PEC) separation process using polyvinyl ferrocene functionalized TiO 2 nanorod electrodes is proposed, which integrates direct solar energy as a driver for the selective electrosorption. The photoelectrochemically-driven oxidation and reduction with both homogeneous and heterogeneous ferrocene-systems is investigated to establish the underlying mechanism. The PEC system can separate heavy metal oxyanions at lower voltages or even without electrical energy. At 0.3 V versus SCE, a 124 mg g −1 uptake for Mo is achieved, which is comparable to the performance of EC cells at 0.75 V versus SCE. Thus, PEC systems not only can generate energy for spontaneous redox-separations, but also can reduce electrical energy consumption by 51.4% compared to EC cells for separation processes when coupled with an external electrical energy.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Observational benchmarks inform representation of soil organic carbon dynamics in land surface models

Abstract. Representing soil organic carbon (SOC) dynamics in Earth system models (ESMs) is a key source of uncertainty in predicting carbon–climate feedbacks. Machine learning models can help identify dominant environmental controllers and establish their functional relationships with SOC stocks. The resulting knowledge can be integrated into ESMs to reduce uncertainty and improve predictions of SOC dynamics over space and time. In this study, we used a large number of SOC field observations (n=54 000), geospatial datasets of environmental factors (n=46), and two machine learning approaches (namely random forest, RF, and generalized additive modeling, GAM) to (1) identify dominant environmental controllers of global and biome-specific SOC stocks, (2) derive functional relationships between environmental controllers and SOC stocks, and (3) compare the identified environmental controllers and predictive relationships with those in models used in Phase 6 of the Coupled Model Intercomparison Project (CMIP6). Our results showed that the diurnal temperature, drought index, cation exchange capacity, and precipitation were important observed environmental predictors of global SOC stocks. While the RF model identified 14 environmental factors that describe climatic, vegetation, and edaphic conditions as important predictors of global SOC stocks (R2=0.61, RMSE = 0.46 kg m−2), current ESMs oversimplify the relationships between environmental factors and SOC, with precipitation, temperature, and net primary productivity explaining > 96 % of the variability in ESM-modeled SOC stocks. Further, our study revealed notable disparities among the functional relationships between environmental factors and SOC stocks simulated by ESMs compared with observed relationships. To improve SOC representations in ESMs, it is imperative to incorporate additional environmental controls, such as the cation exchange capacity, and refine the functional relationships to align more closely with observations.

54 ENVIRONMENTAL SCIENCES↗