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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 181 records · Page 10

From Sim to Real: A Pipeline for Training and Deploying Traffic Smoothing Cruise Controllers

Designing and validating controllers for connected and automated vehicles to enhance traffic flow presents significant challenges, from the complexity of replicating real-world stop-and-go traffic dynamics in simulation, to the intricacies involved in transitioning from simulation to actual deployment. In this work, we present a full pipeline from data collection to controller deployment. Specifically, we collect 772 km of driving data from the I-24 in Tennessee, and use it to build a one-lane simulator, placing simulated vehicles behind real-world trajectories. Using policy-gradient methods with an asymmetric critic, we improve fuel efficiency by over 10% when simulating congested scenarios. Our comprehensive approach includes reinforcement learning for controller training, software verification, hardware validation and setup, and navigating various sim-to-real challenges. Furthermore, we analyze the controller's behavior and wave-smoothing properties, and deploy it on four Toyota Rav4’s in a real-world validation experiment on the I-24. Lastly, we release the driving dataset, the simulator and the trained controller, to enable future benchmarking and controller design.

42 ENGINEERING↗

SIMS Bias on Isotope Ratios in Ca-Mg-Fe Carbonates (Part III): δ 18 O and δ 13 C Matrix Effects Along the Magnesite-Siderite Solid-Solution Series

This study explores the effects of cation composition on mass bias (i.e., the matrix effect), which is a major component of instrumental mass fractionation (IMF) in the microanalyses of δ 13 C and δ 18 O by SIMS in carbonates of the magnesite–siderite solid-solution series (MgCO 3 –FeCO 3 ). A suite of twelve calibration reference materials (RMs) was developed and documented (calibrated range: Fe# = 0.002–0.997, where Fe# = molar Fe/[Mg + Fe]), along with empirical expressions for regressing calibration data (affording residuals < 0.5‰ relative to certified reference material NIST-19). The calibration curves of both isotope systems are non-linear and have, over a 2-year period, fallen into one of two distinct but largely self-consistent shape categories (data from ten measurement sessions), despite adherence to well-established analytical protocols for carbonate δ 13 C and δ 18 O analyses at WiscSIMS (CAMECA IMS 1280). Mass bias was consistently most sensitive to changes in composition near the magnesite end-member (Fe# 0–0.2), deviating by up to 4.5‰ (δ 13 C) and 14‰ (δ 18 O) with increasing Fe content. The cause of variability in calibration curve shapes is not well understood at present and demonstrates the importance of having available a sufficient number of well-characterised RMs so that potential complexities of curvature can be adequately delineated and accounted for on a session-by-session basis.

58 GEOSCIENCES↗

Nonlinear Model Predictive Control Based on Real-Time Iteration Scheme for Wave Energy Converters Using WEC-Sim

One of several challenges that wave energy technologies face is their inability to generate electricity cost-competitively with other grid-scale energy generation sources. Several studies have identified two approaches to lower the levelised cost of electricity: reduce the cost over the device's lifetime or increase its overall electrical energy production. Several advanced control strategies have been developed to address the latter. However, only a few take into account the overall efficiency of the power take-off (PTO) system, and none of them solve the optimisation problem that arises at each sampling time on real-time. In this paper, a detailed Nonlinear model predictive control (NMPC) approach based on the real-time iteration (RTI) scheme is presented, and the controller performance is evaluated using a time-domain hydrodynamics model (WEC-Sim). The proposed control law incorporates the PTO system's efficiency in a control law to maximise the energy extracted. The study also revealed that RTI-NMPC clearly outperforms a simple resistive controller.

model predictive control↗

Comparative study of the native oxide on 316L stainless steel by XPS and ToF-SIMS

The very thin native oxide film on stainless steel, of the order of 2 nm, is known to be readily modified by immersion in aqueous media. In this paper, X-ray photoelectron spectroscopy (XPS) and time of flight secondary ions mass spectrometry are employed to investigate the nature of the air-formed film and modification after water emersion. The film is described in terms of oxide, hydroxide, and water content. The preferential dissolution of iron is shown to occur on immersion. It is shown that a water absorbed layer and a hydroxide layer are present above the oxide-like passive film. The concentrations of water and hydroxide appear to be higher in the case of exposure to water. A secure method for the peak fitting of Fe2p and Cr2p XPS spectra of such films on their metallic substrates is described. The importance of XPS survey spectra is underlined and the feasibility of C{sub 60}{sup +} SIMS depth profiling of a thin oxide layer is shown.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Errata: “Switchable 1,8-diazabicycloundec-7-ene and 1-hexanol ionic liquid analyzed by liquid ToF-SIMS” [Surf. Sci. Spectra 23 , 9 (2016) ]

The identification of a number of mass peaks in the switchable ionic liquid (SWIL) observed in ToF-SIMS is updated based on the most likely chemical formation pathways. The revised identification better reflects the chemical interactions in the SWIL consisting of DBU, 1-hexanol and CO2. A companion paper illustrates the formation mechanism of these updated species is currently under review.

Yao, Juan↗

A New Limitation of the Depth Resolution in TOF-SIMS Elemental Profiling: the Influence of a Probing Ion Beam

New data concerning the influence of a probing beam of bismuth ions on the depth resolution in elemental depth profiling by secondary ion mass spectrometry (SIMS) have been obtained on a TOF.SIMS-5 system using the principle of two separate ion beams. It is established that the existing criterion of nondestructive character of the probing beam, on which this principle is based, is insufficient. Additional processes must be taken into account so as to formulate a more adequate criterion. A regime of depth profiling is proposed that allows the depth resolution to be improved at low energies of sputtering ions.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

ToF-SIMS imaging reveals that p -hydroxybenzoate groups specifically decorate the lignin of fibres in the xylem of poplar and willow

Esterified phenolics occur as γ-linked lignin acylations in many plant taxa but little is known about the distribution or function of such groups. In the family Salicaceae, p-hydroxybenzoate groups are present in the lignin of poplars (Populus spp.) and willows (Salix spp.). In this study, the distribution of cell wall-bound p-hydroxybenzoate was examined in different tissue and cell types of poplar and willow trees. This analysis showed that p-hydroxybenzoate groups were most prevalent in juvenile stems, and were elevated in tension wood and following nitrogen fertilisation. Closer examination of stem cross-sections using time-of-flight secondary-ion mass spectrometry (ToF-SIMS) directly showed that p-hydroxybenzoate groups occur predominantly in the cell walls of fibres and are largely absent from vessel elements. Furthermore, these results point to a role for ester-linked groups in modifying the syringyl-rich lignin of fibres, perhaps to strengthen the cell walls of these structural elements or to increase lignification rates.

59 BASIC BIOLOGICAL SCIENCES↗

Analysis of vapor diffusion Nb$^{3}$Sn coating at Fermilab: Minimizing impurities using TOF-SIMS

Nb₃Sn demonstrates steady advancements nowadays offering reduced power cost in superconducting radio-frequency cavities due to its high critical temperature, quality factor, and achieved accelerating gradient. However, theoretical estimates of its radio-frequency parameters have not been achieved due to several potentially limiting mechanisms: tin spots, patchy regions, defects, thermal impedance, and impurities. While some of these limitations have been intensively studied, impurity analysis in Nb$_3$Sn coatings have received less attention. We report an investigation of impurities in several vapor-diffused Nb₃Sn coated samples using time-of-flight secondary ion mass spectroscopy (TOF-SIMS) and show allowable impurity levels in view of superconducting cavity performance. Challenges and lessons learned in maintaining clean Nb$_3$Sn coatings are also discussed.

Tagdulang, Nikki [Fermilab]↗

SIMS Investigation of Furnace-Baked Nb

Results recently published by Ito et al. showed that "furnace baking" Nb SRF cavities after electropolishing yields high quality factors and anti-Q-slopes resembling that of N doped cavities. Small Nb samples were prepared following the recipe outlined by Ito. These samples were measured by SIMS to examine impurity contributions to the RF penetration layer. These diffusion profiles are modeled, and their consequences on RF properties discussed.

Lechner, E. M.↗

SIMS Investigation of Furnace-Baked Nb

Results recently published by Ito et al. showed that "furnace baking" Nb SRF cavities after electropolishing yields high quality factors and anti-Q-slopes resembling that of N doped cavities. Small Nb samples were prepared following the recipe outlined by Ito. These samples were measured by SIMS to examine impurity contributions to the RF penetration layer. These diffusion profiles are modeled, and their consequences on RF properties discussed.

Lechner, E. M.↗

Chemical Analysis of Tantalum Thin Films compared to Niobium Thin Films using SIMS and XPS

Superconducting qubits are a leading platform for quantum computation. These circuits are typically made from superconducting materials like aluminum or niobium. However, the amorphous niobium oxide and aluminum oxide on the surface of these circuits introduce considerable RF loss due to the presence of two-level systems (TLS), which limits the maximum coherence times T1 to ~100 μs. Capping the niobium qubits with a tantalum layer leads to a 3- 5x improvement [Bal et al., 2024]. But even in this case, tantalum forms an amorphous surface oxide that introduces loss. In an effort to devise strategies to eliminate the presence of this oxide, we present a comprehensive study on the nature of Ta oxide using x-ray photoemission spectroscopy (XPS) and secondary ion mass spectrometry (ToF-SIMS) as a function of heat treatment. The thin films were annealed in ultra-high vacuum conditions and analyzed in situ to characterize the composition and evolution of the native tantalum oxide layer and oxide-metal interface. Our analysis reveals two critical differences between tantalum and niobium oxides: Nb2O5 completely dissolves at 400°C, while Ta2O5 persists even at 800°C. Additionally, tantalum oxide contains only a single suboxide (TaO), in contrast to niobium's two suboxides (NbO and NbO2). The suboxide of tantalum contributes minimally to the total oxide content and shows a relative increase with temperature. Understanding the oxide’s behavior will open new pathways for optimizing coherence times in tantalum qubits.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Challenges of Vapor Diffusion $Nb_3Sn$ Coating at Fermilab: Minimizing Impurities Using TOF-SIMS

Nb$_3$Sn demonstrates steady advancements nowadays offering reduced power cost in superconducting radio-frequency cavities due to its high critical temperature, quality factor, and achieved accelerating gradient. However, theoretical estimates of its radio-frequency parameters have not been achieved due to several potentially limiting mechanisms: tin spots, patchy regions, defects, thermal impedance, and impurities. While some of these limitations have been intensively studied, impurity analysis in Nb$_3$Sn coatings have received less attention. We report an investigation of impurities in several vapor-diffused Nb$_3$Snn coated samples using time-of-flight secondary ion mass spectroscopy (TOF-SIMS) and show allowable impurity levels in view of superconducting cavity performance. Challenges and lessons learned in maintaining clean Nb$_3$Sn coatings are also discussed.

Tagdulang, N. [Fermilab]↗

(GO) 2 -SIM: a GCM-oriented ground-observation forward-simulator framework for objective evaluation of cloud and precipitation phase

General circulation model (GCM) evaluation using ground-based observations is complicated by inconsistencies in hydrometeor and phase definitions. Here we describe (GO) 2 -SIM, a forward simulator designed for objective hydrometeor-phase evaluation, and assess its performance over the North Slope of Alaska using a 1-year GCM simulation. For uncertainty assessment, 18 empirical relationships are used to convert model grid-average hydrometeor (liquid and ice, cloud, and precipitation) water contents to zenith polarimetric micropulse lidar and Ka-band Doppler radar measurements, producing an ensemble of 576 forward-simulation realizations. Sensor limitations are represented in forward space to objectively remove from consideration model grid cells with undetectable hydrometeor mixing ratios, some of which may correspond to numerical noise. Phase classification in forward space is complicated by the inability of sensors to measure ice and liquid signals distinctly. However, signatures exist in lidar–radar space such that thresholds on observables can be objectively estimated and related to hydrometeor phase. The proposed phase-classification technique leads to misclassification in fewer than 8 % of hydrometeor-containing grid cells. Such misclassifications arise because, while the radar is capable of detecting mixed-phase conditions, it can mistake water- for ice-dominated layers. However, applying the same classification algorithm to forward-simulated and observed fields should generate hydrometeor-phase statistics with similar uncertainty. Alternatively, choosing to disregard how sensors define hydrometeor phase leads to frequency of occurrence discrepancies of up to 40 %. So, while hydrometeor-phase maps determined in forward space are very different from model reality they capture the information sensors can provide and thereby enable objective model evaluation.

54 ENVIRONMENTAL SCIENCES↗

Crystallographic Characterization of Nb3Sn Coatings and N-Doped Niobium via EBSD and SIMS

Historically, niobium has been used as the superconducting material in SRF cavities. Due the high operational costs, other materials are currently being considered. Nb3Sn coatings have been investigated over the past several decades, motivated by potentially higher operating temperatures. More recently niobium has been doped with nitrogen to improve the quality factor (Q). Currently, a need for better understanding still exists for both mechanisms. EBSD has been shown to be a viable technique to determine the crystallographic orientation and the size of the Nb3Sn grains. The EBSD maps obtained show a bimodal distribution of grain sizes with smaller Nb3Sn grains found present near the Nb3Sn/Nb interface. In addition to the Nb3Sn coatings, N-doped niobium coupons were analyzed by EBSD and found that the coupon had preferred surface orientation. The EBSD analysis was found to be vital as specific grains could be targeted in SIMS to better understand the diffusion of nitrogen with respect to crystal orientation.

Angle, J. W.↗

Nonlinear Model Predictive Control Based on Real-Time Iteration Scheme for Wave Energy Converters Using WEC-Sim: Preprint

One of several challenges that wave energy technologies face is their inability to generate electricity cost-competitively with other grid-scale energy generation sources. Several studies have identified two approaches to lower the levelised cost of electricity: reduce the cost over the device's lifetime or increase its overall electrical energy production. Several advanced control strategies have been developed to address the latter. However, only a few take into account the overall efficiency of the power take-off (PTO) system, and none of them solve the optimisation problem that arises at each sampling time on real-time. In this paper, a detailed Nonlinear model predictive control (NMPC) approach based on the real-time iteration (RTI) scheme is presented, and the controller performance is evaluated using a time-domain hydrodynamics model (WEC-Sim). The proposed control law incorporates the PTO system's efficiency in a control law to maximise the energy extracted. The study also revealed that RTI-NMPC clearly outperforms a simple resistive controller.

model predictive control↗

Measurement of Inclusive Charged-Current $\barν_μ$ Scattering on C, CH, Fe, and Pb at $\langle E_{\barν}\rangle \sim$ 6 GeV with MINERvA

We report MINERvA's first measurement of inclusive charged-current $\barν_μ$ cross sections on carbon, hydrocarbon, iron, and lead, and their ratios to the cross section on hydrocarbon, as functions of the antimuon transverse momentum, $p_{\mathrm{T}}$. Using a wide-band $\barν_μ$ beam with mean energy $\sim 6~\text{GeV}$, these measurements probe all interaction modes, including the transition from resonance production to deep-inelastic scattering. The total uncertainties are typically $5-10\%$ for the absolute cross sections and $2-5\%$ for the ratios. Comparisons with multiple neutrino interaction models reveal significant discrepancies in the $p_{\mathrm{T}}$ dependence, particularly for heavier nuclei. The disagreements are most pronounced at low $p_{\mathrm{T}}$ but extend across the full $p_{\mathrm{T}}$ range, indicating missing or mis-modelled nuclear effects.

Klustová, A. [Imperial Coll., London] (ORCID:00000↗