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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 883 records · Page 49

Resumption of SFR Overpower Testing and Post-Transient Examination of the THOR-C-2 Irradiation Test

Transient overpower testing for fuel safety research and development has resumed at Idaho National Laboratory. The THOR-C-2 commissioning test has been performed and post-transient examination has been performed revealing the intended creep rupture failure near the top of the fuel zone. This paves the way for future testing on previously irradiated fuels that will support fuel development and qualification.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Resumption of SFR Overpower Testing and Post-Transient Examination of the THOR-C-2 Irradiation Test

Transient overpower testing for fuel safety research and development has resumed at Idaho National Laboratory. The THOR-C-2 commissioning test has been performed and post-transient examination has been performed revealing the intended failure near the top of the fuel zone. This paves the way for future testing on previously irradiated fuels that will support fuel development and qualification.

advanced reactors↗

The Transient Covalent Bond in Abiotic Nonequilibrium Systems

Biochemical systems accomplish many critical functions with by operating out-of-equilibrium using the energy of chemical fuels. The formation of a transient covalent bond is a simple but very effective tool in designing analogous reaction networks. This Minireview focuses on the fuel chemistries that have been used to generate transient bonds in recent demonstrations of abiotic nonequilibrium systems (i.e., systems that do not make use of biological components). Here, fuel reactions are divided into two fundamental classifications depending on whether the fuel contributes structural elements to the activated state, a distinction that dictates how they can be used. Reported systems are further categorized by overall fuel reaction (e.g., hydrolysis of alkylating agents, carbodiimide hydration) and illustrate how similar chemistry can be used to effect a wide range of nonequilibrium behavior, ranging from self-assembly to the operation of molecular machines.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

MaLTESE: Large-Scale Simulation-Driven Machine Learning for Transient Driving Cycles

Optimal engine operation during a transient driving cycle is the key to achieving greater fuel economy, engine efficiency, and reduced emissions. In order to achieve continuously optimal engine operation, engine calibration methods use a combination of static correlations obtained from dynamometer tests for steady-state operating points and road and/or track performance data. As the parameter space of control variables, design variable constraints, and objective functions increases, the cost and duration for optimal calibration become prohibitively large. In order to reduce the number of dynamometer tests required for calibrating modern engines, a large-scale simulation-driven machine learning approach is presented in this work. A parallel, fast, robust, physics-based reduced-order engine simulator is used to obtain performance and emission characteristics of engines over a wide range of control parameters under various transient driving conditions (drive cycles). We scale the simulation up to 3,906 nodes of the Theta supercomputer at the Argonne Leadership Computing Facility to generate data required to train a machine learning model. The trained model is then used to predict various engine parameters of interest, and the results are compared with those predicted by the engine simulator. Our results show that a deepneural-network-based surrogate model achieves high accuracy: Pearson product-moment correlation values larger than 0.99 and mean absolute percentage error within 1.07% for various engine parameters such as exhaust temperature, exhaust pressure, nitric oxide, and engine torque. Once trained, the deep-neural-network-based surrogate model is fast for inference: it requires about 16 mu s for predicting the engine performance and emissions for a single design configuration compared with about 0.5 s per configuration with the engine simulator. Moreover, we demonstrate that transfer learning and retraining can be leveraged to incrementally retrain the surrogate model to cope with new configurations that fall outside the training data space.

deep learning↗

Investigation of Transient Xenon Processes in VVER-1200 at the Novovoronezh NPP

The results of experimental studies of the integral and spatial transient xenon processes in the No. 6 unit of the Novovoronezh NPP with VVER-1200 are presented. An unconventional method of measurement was tested in the study of integral processes: the course of the xenon process was recorded as the change in the critical concentration of boric acid in the reactor simultaneously with a calculation of the concentration in real-time. The spatial transient processes were studied for the example of axial and diametral free xenon oscillations of energy release in the core.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Analysis of Transient Recovery Voltage at the Terminals of Breakers Using Current-Limiting Reactors

Current-limiting reactors (CLR) are known to have a significant effect on transition processes during short circuits (SC) leading to excesses beyond the permissible values of the transient recovery voltage (TRV) at the terminals of breakers for short-circuit currents, which in turn can lead to failure of the breakers. It is shown that the traditional (generally accepted) method for calculating transient recovery voltages based on using a circuit with the reactor replaced by lumped parameters is not suitable for magnetized CLR, and in the case of uncontrolled CLR can yield erroneous results. It is argued that there is a need to account for the distribution of the winding parameters of current-limiting reactors in calculations of the TRV at the contacts of breakers as they interrupt short circuits and relevant analytic expressions are derived.

42 ENGINEERING↗

A quasi-static Monte Carlo algorithm for the simulation of sub-prompt critical transients

A pseudo-time-dependent Monte Carlo algorithm suitable for simulating thermal reactor transients with timescales on the order of seconds is presented. An initial experimental implementation has been written into the Monte Carlo Application ToolKit (MCATK) developed at Los Alamos National Laboratory. The algorithm is essentially a combination of the fully time-dependent Monte Carlo algorithm, including the explicit simulation of delayed neutron precursors, and a quasi-static algorithm that does not use the point-kinetics equations. The fully time-dependent calculation is performed for some number of inactive and active micro time steps. The dynamic reactor time constant and delayed neutron precursor production rates are calculated directly from the active cycles, rather than from point-kinetics parameters. These quantities are then used to advance the neutron population and delayed neutron precursors forward in time across a macro time step. As a result, the method is applied to the C5G7-TD benchmark operating in steady state and in transient mode.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Generation of localized reactor point kinetics parameters using coupled neutronic and thermal fluid models for pebble-bed reactor transient analysis

The systems analysis of anticipated operating occurrences and design basis accidents for pebble-bed reactor systems requires knowledge of neutron point kinetics equations (PKE) parameters. Typically, the generation of PKE parameters is performed in a global manner using standalone neutronics calculations, without the inclusion of thermal fluid distributions. We utilize Griffin and Pronghorn for generating global and local PKE parameters which includes the use of thermal fluid distributions to account for localized effects. This work establishes a methodology for calculating PKE parameters for a pebble bed reactor with a coupled neutronics/thermal fluids analysis. PKE parameters generated on a global and local basis are compared against a diffusion solve for a typical load-following transient. Locally-generated neutron kinetic parameters are able to reduce the maximum error in the transient power level from 5% to below 1.5%; along with this, bulk temperature errors were reduced from 12 K to 4 K.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Roles of PTEN-induced putative kinase 1 and dynamin-related protein 1 in transient global ischemia-induced hippocampal neuronal injury

Recent studies showed that increased mitochondrial fission is an early event of cell death during cerebral ischemia and dynamin-related protein 1 (Drp1) plays an important role in mitochondrial fission, which may be regulated by PTEN-induced putative kinase 1 (PINK1), a mitochondrial serine/threonine-protein kinase thought to protect cells from stress-induced mitochondrial dysfunction and regulate mitochondrial fission. However, the roles of PINK1 and Drp1 in hippocampal injury caused by transient global ischemia (TGI) remain unknown. We therefore tested the hypothesis that TGI may induce PINK1 causing downregulation of Drp1 phosphorylation to enhance hippocampal neuronal survival, thus functioning as an endogenous neuroprotective mechanism. We found progressively increased PINK1 expression in the hippocampal CA1 subfield1-48 h following TGI, reaching the maximal level at 4 h. Despite lack of changes in the expression level of total Drp1 and phosphor-Drp1 at Ser637, TGI induced a time-dependent increase of Drp1 phosphorlation at Ser616 that peaked after 24 h. Notably, PINK1-siRNA increased p-Drp1(Ser616) protein level in hippocampal CA1 subfield 24 h after TGI. The PINK1 siRNA also aggravated the TGI-induced oxidative DNA damage with an increased 8-hydroxy-deoxyguanosine (8-OHdG) content in hippocampal CA1 subfield. Furthermore, PINK1 siRNA also augmented TGI-induced apoptosis as evidenced by the increased numbers of TUNEL-positive staining and enhanced DNA fragmentation. These findings indicated that PINK1 is an endogenous protective mediator vital for neuronal survival under ischemic insult through regulating Drp1 phosphorylation at Ser616. - Highlights: • Transient global ischemia increases expression of PINK1 and p-Drp1 at Ser616 in hippocampal CA1 subfield. • PINK1-siRNA decreases PINK1 expression but increases p-Drp1 at Ser616 in hippocampal CA1 subfield. • PINK1-siRNA augments oxidative stress and neuronal damage in hippocampal CA1 subfield.

60 APPLIED LIFE SCIENCES↗

CH 4 internal dry reforming over a Ni/YSZ/ScSZ anode catalyst in a SOFC: A transient kinetic study

We used a transient kinetic technique, which involves a step-switching of the reactant flows, to identify the reaction pathways on the Ni anode catalysts of SOFCs utilizing CH 4 /CO 2 and CH 4 as fuels. Carbon deposited at the external layer of the Ni anode support in CH 4 -SOFC. The transient response revealed that carbon deposition, which occurred with CH 4 as a fuel molecule, was suppressed and dominated by the dry reforming of CH 4 /CO 2 to CO/H 2 and the electrochemical oxidization of CO/H 2 . In conclusion, electricity generation from the electrochemical oxidation reactions is governed by Faraday resistance at the anode Ni catalyst interlayer.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Addition of transient kinetics capabilities to an infrared reflection absorption spectroscopy system through synchronized gas pulsing and data acquisition

Surface science methodologies for understanding thermodynamic aspects of surface processes are at an advanced level. However, instrumentation and approaches for extracting kinetic parameters from elementary steps are far less accessible. In this work, we present an approach combining the use of a fast gas pulsing valve synchronized with data acquisition to enable surface transient kinetics studies using infrared reflection absorption spectroscopy. This methodology applies to the study of reversible processes and borrows concepts and ideas from molecular beam scattering and temporal analysis of products. Here, a temporal resolution of ~67 ms is achieved, and this is illustrated through the study of CO adsorption and desorption on a Pd(111) crystal in the presence and absence of background O 2 . The same approach can be extended to other surface spectroscopies, such as X-ray photoelectron spectroscopy, to obtain spectra with high temporal resolution and signal-to-noise ratio and enable future multimodal surface transient kinetic studies aiming at elucidating reaction mechanisms.

36 MATERIALS SCIENCE↗

Transient kinetic insights into selective propene oxidation over industrial bismuth molybdate catalysts

Selective oxidation of propene to acrolein over industrial multicomponent bismuth molybdate (BMO) catalysts significantly depends on reaction conditions that include operating parameters and catalyst state. Here, this work investigates selective propene oxidation in the intrinsic kinetic paradigm of Temporal Analysis of Products (TAP) reactor by systematically varying catalyst redox state, temperature, and oxygen-to-propene feed ratio. A 93 % propene conversion with an acrolein yield of 80 % is achieved at elevated temperatures (450 °C) on oxidized catalysts under oxygen-rich conditions (O 2 :C 3 H 6 = 10). However, these conditions diminish acrolein-to-CO 2 selectivity due to enhanced total oxidation to CO 2 . In contrast, a reduced catalyst state, moderate temperature (350 °C), and lower oxygen feed (O 2 :C 3 H 6 = 1) nearly doubles the acrolein to-CO 2 selectivity, albeit at a lower acrolein yield (33 %). Transient kinetic studies together with a kinetic model that simplify the major product formation pathways in lumped non-elementary forms reveal that the availability of surface oxygen species plays a pivotal role in governing reaction pathways. Additionally, density functional theory (DFT) calculations on pure BMO catalysts inform the role of surface redox states on propene and oxygen activation barriers. Lattice oxygen at acrolein-selective sites drives both acrolein and CO 2 formation, while adsorbed oxygen at activation sites favors unselective CO 2 generation. This work establishes a critical relationship between transient product selectivity and surface oxygen availability, which is strongly influenced by catalyst redox state, feed ratio, and reaction temperature. These insights underscore the importance of dynamic reactor operation strategies and offer a foundation for designing next-generation propene oxidation processes with tunable acrolein selectivity.

42 - ENGINEERING↗

One-dimensional, transient modeling of a fixed-bed regenerator as a replacement for recuperators in supercritical CO 2 power cycles

Fixed-bed regenerators may be a low cost alternative to recuperators for supercritical CO 2 power cycles. However, the transient nature of regenerators operating in sCO 2 power cycles has not been previously characterized. This study details a one-dimensional, transient model of a fixed-bed regenerator that captures phenomena such as local fluid properties and heat transfer coefficients, entrained fluid heat capacity, and the effects of conservation of mass during process switching. The model is validated with experimental results of a 10 kWth regenerator. This comparison shows that the model predicts temperature as a function of both time and space exceptionally well. The model predicts effectiveness, heat transfer, and discharge temperatures within 5%, and predicts pressure drop and fluid carryover within 10%. This model could be used in future studies to simulate regenerators within a supercritical CO 2 power cycle.

30 DIRECT ENERGY CONVERSION↗

Adaptive Interface-PINNs (AdaI-PINNs) for transient diffusion: Applications to forward and inverse problems in heterogeneous media

We model transient diffusion in heterogeneous materials using a novel physics-informed neural networks framework (PINNs) termed Adaptive interface physics-informed neural networks or AdaI-PINNs (Roy et al. arXiv preprint arXiv:2406.04626, 2024). AdaI-PINNs utilize different activation functions with trainable slopes tailored to each material region within the computational domain, allowing for a fully automated and adaptive PINNs approach to model interface problems with strongly and weakly discontinuous solutions. To enhance its performance in highly heterogeneous transient diffusion systems, we prescribe a suite of robust practices, including appropriate non-dimensionalization of equations, a biased sampling method, Glorot initialization, and the hard enforcement of boundary and initial conditions. Here we evaluate the efficacy of the proposed method on several benchmark forward and inverse problems. Comparative studies on one-dimensional and two-dimensional benchmark problems reveal that the modified AdaI-PINNs outperform its unmodified counterpart, achieving root-mean-square errors that are at least two orders of magnitude better in forward problems. For inverse problems, the maximum errors in the approximated diffusion coefficients by modified AdaI-PINNs are four orders of magnitude better than those of the unmodified version. Additionally, modified AdaI-PINNs demonstrate improved stability in problems with large material mismatches.

42 ENGINEERING↗

Perspective on the oil-dominated gas hydrate plugging conceptual picture as applied to transient Shut-In/Restart

Gas hydrate formation is rarely an issue during continuous production conditions. Unplanned and/or extended shut-downs comprise the majority of scenarios where overlapping concern and uncertainty for gas hydrate blockages exist. To date, most experimental studies and theoretical analysis of gas hydrate formation derive from the steady-state conceptual picture. Yet, significant distinctions induced by phase separation and prolonged cooling suggest an altered conceptual picture is required for transient shut-in/restart operations. To address this outstanding issue, this work presents a conceptual picture for the base case of a non-surface active hydrocarbon undergoing cold restart without enacted mitigation efforts. First, phase separation upon shut-in leads to the localization of gas hydrate ingredients due to fluids density differences and pipeline inclination. Cooling to the seafloor temperature, then, induces gas hydrate film formation at the hydrocarbon interface and maximizes subcooling, resulting in rapid and confined gas hydrate growth occurring upon restart. Furthermore, this ultimately leads to plugging dominated by the deposition of porous, low conversion gas hydrate masses. Direct visual observations and results from Raman spectroscopy, hydrate contact angle and film growth, micromechanical force apparatus, rocking cell, and flow loop studies support the mechanisms outlined within each step. Similar to the influence provided by the original Colorado School of Mines steady-state conceptual picture that was introduced about 15 years ago, this transient counterpart builds a foundation that could inspire new directions of hydrate research and analysis in areas where uncertainty abounds.

02 PETROLEUM↗

Utilization of an Advanced Sensor network to determine fuel heating value and Real-Time net unit heat rate during transient operation

Coal-fired utility boilers are being increasingly used as variable electricity generation to resolve the imbalance in the energy market from the expansion of intermittent renewable energy. The frequent transient operation required to meet residual energy demand has created a challenge for coal-fired units to operate efficiently. This work utilizes an advanced sensor network (ASN) to calculate net unit heat rate (NUHR) of a coal-fired boiler in real time through combustion calculations and statistical correlations to provide the tools for optimizing dynamic operation. Real-time heating values that were necessary to determine fuel input energy to calculate accurate NUHR were found using both fundamental and data-driven methods. Real-time NUHR shows distinct shifts that reflect changes in process conditions that will improve the ability to optimize transient operation. Data-driven heating value correlations had 24% lower root mean square error (RMSE) than the fundamental combustion calculation approach when compared to daily retrospective proximate analysis. Furthermore, the data-driven method RMSE improved by 7% with the inclusion of ASN data. Future work is to validate by comparing unit performance with and without the inclusion of NUHR as a control parameter for the dynamic neural network.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Cause identification of electromagnetic transient events using spatiotemporal feature learning

This paper presents a spatiotemporal feature learning method for cause identification of electromagnetic transient events in power grids. The proposed method is formulated based on the availability of time-synchronized high-frequency measurements and using the convolutional neural network as the spatiotemporal feature representation along with softmax function for the classification. Despite the existing threshold-based, or energy-based events analysis methods, such as support vector machine autoencoder, and tapered multi-layer perceptron neural network, the proposed feature learning is carried out with respect to both time and space. The effectiveness of the proposed feature learning and the subsequent cause identification is validated through the Electromagnetic Transients Program (EMTP) simulation of different events such as line energization, capacitor bank energization, lightning, fault, and high-impedance fault in the IEEE 30-bus, and the real-time digital simulation of the Western System Coordinating Council (WSCC) 9-bus system.

42 ENGINEERING↗

Analyte-induced spectral filtering in femtosecond transient absorption spectroscopy

Here, we discuss the influence of spectral filtering by samples in femtosecond transient absorption measurements. Commercial instruments for transient absorption spectroscopy (TA) have become increasingly available to scientists in recent years and TA is becoming an established technique to measure the dynamics of photoexcited systems. Furthermore, we show that absorption of the excitation pulse by the sample can severely alter the spectrum and consequently the temporal pulse shape. This “spectral self-filtering” effect can lead to systematic errors and misinterpretation of data, most notably in concentration dependent measurements. Finally, the combination of narrow absorption peaks in the sample with ultrafast broadband excitation pulses is especially prone to this effect.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗