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DOE OSTI2025

Platinum–Ruthenium Alloys Are Not Bifunctional CO Electro-Oxidation Catalysts: A Kinetic Analysis

Electro-oxidation of CO is a common kinetic bottleneck in many types of fuel cells and organic electrosynthesis processes. Alloys of Pt and Ru are often used as anode catalysts, with high activity attributed to bifunctionality; this suggests that Ru preferentially activates water to form surface hydroxyl groups that can react with Pt-bound CO. However, rigorous kinetic measurements have not confirmed this assertion under steady-state electro-oxidation conditions. Here, CO electro-oxidation is analyzed using several commercial Pt/C and Pt 100-x Ru x /C nanoparticle catalysts in acidic and alkaline electrolytes. Kinetic observables including apparent transfer coefficients and reaction orders are measured and evaluated using a degree of rate control analysis. The kinetic observables for both Pt and PtRu alloys are most consistent with competitive adsorption and Langmuir–Hinshelwood coupling across a single site-type, rather than two distinct sites. Furthermore, the role of Ru in CO electro-oxidation is assigned to be a purely electronic effect.

Alcohols↗

DOE OSTI2023

Evaluating the sustainability of the 2017 US biofuel industry with an integrated techno-economic analysis and life cycle assessment

The United States produced more than 66.2 billion Liters of biofuel, primarily in the form of corn ethanol (61 billion Liters) and soybean biodiesel (6 billion Liters), for the transportation industry in 2017. No work currently exists that evaluates both the economic and environmental outcomes of this industry with adequate geospatial resolution and national scope. In this study, a model framework is constructed to perform Techno-Economic Analysis and Life Cycle Assessment using high-resolution input datasets to provide a granular estimation of corn ethanol and soybean biodiesel sustainability performance in most counties in the United States in 2017 (the most recent year for which data is available). Results show a total life cycle, greenhouse gas emission volume of 99.5 million Mg CO 2-eq produced in 2017 by these two biofuels (94.8 million Mg from corn ethanol, and 4.7 million Mg from soybean biodiesel), excluding indirect land use change emissions. Further, this volume corresponds to a combined carbon intensity of 65.3 gCO 2-eq /MJ, which is a greenhouse gas improvement compared to petroleum-based gasoline (the carbon intensity of conventional gasoline is 93.0 gCO 2-eq /MJ). However, these biofuels are produced at an additional economic cost ($1.8 billion over the displaced gas/diesel). Additionally, these biofuels generate unfavorable impacts in other environmental categories when compared to petroleum-based fuels, particularly in areas of water, land, and nitrogen intensity. This work enables stakeholders to assess the specific value of biofuels as a means of emission reduction and determine if the attained improvements are worth the associated opportunity costs.

09 BIOMASS FUELS↗

DOE OSTI2025

3D Multiphysics Model for Large Scale Planar Cell: Inductance Investigation in Impedance Analysis

Developed a comprehensive 3D multiphysics model to analyze impedance behavior in large-scale planar Solid Oxide Fuel Cells (SOFCs). The model investigates how impedance varies across operating conditions and cell components, with a particular focus on inductive loops or negative capacitance at the air electrode. It was found that the Inductive loop disappears in the low-frequency zone when the activation overpotential or faradic current is not temperature-dependent. These findings offer new insights into SOFC impedance behavior.

impedence analysis↗

NASA NTRSDate not supplied

Quantification of Design Trade-Offs When Comparing Transonic Truss-Braced Wing to Advanced Tube and Wing Aircraft

Interest in novel aircraft configurations has continued to grow in response to increasing demand for improved fuel efficiency. One such configuration of interest is the Transonic Truss-Braced Wing (TTBW). Because the improvement of the TTBW comes from increased efficiency during cruise, it offers increasing returns as the mission distance increases. As a result, there is often a crossover point which represents the minimum mission range where the TTBW will offer a fuel burn reduction relative to a similar Tube and Wing aircraft with similar component technology levels. Aircraft rarely fly missions at their maximum range, so it is important to investigate not only the maximum benefit, but also the most likely benefit. Design decisions and analysis assumptions that significantly impact this crossover point include whether to put fuel in body tanks, how weight build-up estimation is calibrated, engine technology selection, and flight Mach number. This study, conducted under NASA’s Sustainable Flight Demonstration project and inspired by differing assumptions made by different research teams, details the impacts of changing these design decisions and assumptions.

Carl J Recine↗

NASA NTRSDate not supplied

Quantification of Design Trade-Offs When Comparing Transonic Truss-Braced Wing to Advanced Tube and Wing Aircraft

Carl J Recine↗

NASA NTRS2005

Solid Oxide Fuel Cell/Gas Turbine Hybrid Cycle Technology for Auxiliary Aerospace Power

A notional 440 kW auxiliary power unit has been developed for 300 passenger commercial transport aircraft in 2015AD. A hybrid engine using solid-oxide fuel cell stacks and a gas turbine bottoming cycle has been considered. Steady-state performance analysis during cruise operation has been presented. Trades between performance efficiency and system mass were conducted with system specific energy as the discriminator. Fuel cell performance was examined with an area specific resistance. The ratio of fuel cell versus turbine power was explored through variable fuel utilization. Area specific resistance, fuel utilization, and mission length had interacting effects upon system specific energy. During cruise operation, the simple cycle fuel cell/gas turbine hybrid was not able to outperform current turbine-driven generators for system specific energy, despite a significant improvement in system efficiency. This was due in part to the increased mass of the hybrid engine, and the increased water flow required for on-board fuel reformation. Two planar, anode-supported cell design concepts were considered. Designs that seek to minimize the metallic interconnect layer mass were seen to have a large effect upon the system mass estimates.

Steffen, Christopher J., Jr.↗

DOE OSTI2021

Assessment of ORIGEN Reactor Library Development for Pebble-Bed Reactors Based on the PBMR-400 Benchmark

This report provides an evaluation of present SCALE capabilities for modeling depletion of pebble-bed reactor systems, using the PBMR-400 benchmark as a test case. A specific aim of this work is to understand the system characteristics required to generate production-quality reactor data libraries for rapid depletion calculations with ORIGEN. This report includes a discussion of present SCALE capabilities for modeling doubly heterogeneous fuels, prior SCALE work modeling pebble bed–type reactors, and a detailed neutronic analysis of the PBMR-400 core for both fresh and equilibrium-composition core conditions.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

DOE OSTI2024

Pressurized-Water Reactor Core Design using Multi-Objective Plant Fuel Reload Optimization Platform

The United States (U.S.) Department of Energy (DOE) Light Water Reactor Sustainability (LWRS) Program Risk-Informed Systems Analysis (RISA) Pathway Plant Reload Optimization Project aims to develop an integrated, comprehensive framework offering an all-in-one solution for reload evaluations with a special focus on optimization of core design. The optimization of the fuel loading pattern is one of the most important considerations in reducing the amount of new fuel used in the core. Due to thousands of possible options of core configuration, finding optimal solutions is an unachievable task for a human. The Plant ReLoad Optimization (PRLO) platform which supports artificial-intelligence-based reactor core designing is now fully capable of handling realistic problems. The PRLO Platform development project aims to build a reactor core design tool that includes reactor safety and fuel performance analyses and uses artificial intelligence to support the optimization of core design solutions. The NSGA-II (Non-dominated Sorting Genetic Algorithm-II) optimizer was developed and tested within RAVEN (Risk Analysis and Virtual Environment) to handle many constraints by using an augmented objectives methodology. The demonstration was performed with constrained multi-objective optimization of a 17 × 17 pressurized-water reactor core loading patterns to minimize fuel cost and maximize fuel cycle length.

42 ENGINEERING↗

DOE OSTI2025

Nuclear Reactor Heat Extraction for Synthetic Fuel Plants

This report looks at the viability and best approach when producing synthetic fuels using heat and power supplied by advanced nuclear energy systems. The report looks at a low temperature integration pathway with four types of advanced reactors: a pressurized water reactor (PWR), an advanced light water reactor (A-LWR), a sodium fast reactor (SFR), and a high-temperature gas-cooled reactor (HTGR). A failure modes and effects analysis (FMEA) of the coupling system between the nuclear plant and the synthetic fuel systems is performed with the goal of identifying the reliability of such a thermal delivery system. Furthermore, a high temperature pathway is investigated for synfuel coupling to determine if this is more efficient and more cost effective as a coupling approach.

10 - SYNTHETIC FUELS↗

DOE OSTI2020

How do the research and public communities view biofuel development?

Understanding how public and research view biofuel development, especially the unsynchronized views, can explain the gaps between the actual biofuel production and consumption and the government mandates in the US. Applying a comparative text mining technique, these views are explored using 9924 news articles and 57,849 research abstracts. It is found both the public and research communities respond actively to major policy and incentive programs and market conditions and the public has been closely following important research advances. However, research and practice should be coordinated to achieve economies of scale for regular and alternative biofuels. Priority is particularly needed for policy research to support legislation and enforcement and remove technical barriers to commercialization; meanwhile, greater attention is needed to prompt the commercialization of mature technologies. In addition, sentiment analysis shows positive public perceptions in general and negative perceptions primarily stemming from fraud in biofuel tax-credit programs with minor concerns on unintended negative impacts of biofuel development and policy implementation issues. This study contributes to methodology by using cutting-edge text-mining techniques to the largest and most up-to-date datasets of public news articles and research publication abstracts so as to compare public and academic views on biofuel development. As a result, this study also contributes to knowledge discovery by providing new perspectives on biofuel development, which will support policy design and identify future research directions.

09 BIOMASS FUELS↗

NASA NTRS1992

Transient/structural analysis of a combustor under explosive loads

The 8-Foot High Temperature Tunnel (HTT) at NASA Langley Research Center is a combustion-driven blow-down wind tunnel. A major potential failure mode that was considered during the combustor redesign was the possibility of a deflagration and/or detonation in the combustor. If a main burner flame-out were to occur, then unburned fuel gases could accumulate and, if reignited, an explosion could occur. An analysis has been performed to determine the safe operating limits of the combustor under transient explosive loads. The failure criteria was defined and the failure mechanisms were determined for both peak pressures and differential pressure loadings. An overview of the gas dynamics analysis was given. A finite element model was constructed to evaluate 13 transient load cases. The sensitivity of the structure to the frequency content of the transient loading was assessed. In addition, two closed form dynamic analyses were conducted to verify the finite element analysis. It was determined that the differential pressure load or thrust load was the critical load mechanism and that the nozzle is the weak link in the combustor system.

Gregory, Peyton B.↗

DOE OSTI2025

MARIE: A Python-Based Framework for Comprehensive Fuel Recycling Modeling

One of the most pressing challenges to the continued deployment of nuclear energy systems is in the ultimate management and disposition of discharged fuel assemblies. While reprocessing and recovery of valuable materials from UNF assemblies has been considered as part of an overall strategy for minimization of the volume of reactor-based wastes to be managed, the deployment of commercial-scale reprocessing facilities presents an enormous economic challenge. The MARIE software package has been developed as a means of confronting this challenge. Representing components of a generic fuel reprocessing operation as individual physical processes, MARIE is designed as a modular framework intended to allow for analysis and cost-optimization for a hypothetical reprocessing facility while realistically accounting for the physical characteristics of the used fuel source term, such as decay heat, activity, and radiation dose (informing corresponding shielding requirements). Capabilities supported by MARIE include head-end operations such as fuel shearing, voloxidation, and dissolution; generic solvent extraction operations informed by available open-literature data; a suite of unit operations intended to represent electrochemical processing of used fuel assemblies (i.e., oxide reduction, electrorefining, and electrowinning); and finally, accounting for both costs and physical features of discharged waste streams, which can be used to inform follow-on analyses such as the feasibility of deep-borehole disposal of HLW. This paper presents an overview of the MARIE software capabilities, including how individual unit operations are implemented to enable a larger-scale optimization of a hypothetical reprocessing operation on aspects such as cost and recovery of valuable materials.

Skutnik, Steve [ORNL] (ORCID:000000016441135X)↗

DOE OSTI2020

Borehole Disposal: Update on the Science, Technology, and Potentially Suitable Radioactive Wastes - 20170

A recent Special Issue of the Energies Journal on Deep Borehole Disposal of Nuclear Waste has delivered a timely update on the science and technology of borehole disposal and the types of radioactive wastes it could potentially accommodate. The Special Issue papers discuss (i) circumstances under which a national waste management programme might wish to consider deep borehole disposal [1], (ii) a status report of deep borehole disposal options in Germany [2], (iii) the use of deep horizontal drill-holes in sedimentary, metamorphic or igneous rocks for disposal of spent nuclear fuel and high-level radioactive waste [3], (iv) the analysis of corrosion performance of engineered barrier systems [4], (v) a review of the potential cementing systems suitable for deep borehole disposal [5], (vi) the thermal evolution around heat-generating waste for a wide range of material properties and disposal configurations [6], (vii) a geochemical analysis of deep brines focussed on fluid-rock interactions [7], (viii) post-closure performance assessment calculations for deep borehole disposal of Cs/Sr capsules [8], and (ix) an example safety case for deep borehole disposal of nuclear wastes [9]. This paper provides an overview of the main findings from these publications and highlights some of the technological and scientific challenges that need to be overcome when developing a deep borehole disposal concept. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

NASA NTRS2004

Performance Benefits for a Turboshaft Engine Using Nonlinear Engine Control Technology Investigated

The potential benefits of nonlinear engine control technology applied to a General Electric T700 helicopter engine were investigated. This technology is being developed by the U.S. Navy SPAWAR Systems Center for a variety of applications. When used as a means of active stability control, nonlinear engine control technology uses sensors and small amounts of injected air to allow compressors to operate with reduced stall margin, which can improve engine pressure ratio. The focus of this study was to determine the best achievable reduction in fuel consumption for the T700 turboshaft engine. A customer deck (computer code) was provided by General Electric to calculate the T700 engine performance, and the NASA Glenn Research Center used this code to perform the analysis. The results showed a 2- to 5-percent reduction in brake specific fuel consumption (BSFC) at the three Sikorsky H-60 helicopter operating points of cruise, loiter, and hover.

Jones, Scott M.↗

DOE OSTI2020

Experimental and Kinetic Modeling Study of Laminar Burning Velocities of Cyclopentanone and Its Binary Mixtures with Ethanol and n-Propanol

Cyclopentanone is a promising biofuel that can enable more efficient engine operation and increase the fuel economy of the light duty fleet over current and planned technology developments. While the ignition of cyclopentanone has been investigated in detail, more studies on the laminar burning velocities of cyclopentanone are called for. In this work, the laminar burning velocities of cyclopentanone (C 5 H 8 O) have been measured using the heat flux and spherical flame methods at 1 atm, equivalence ratios from 0.7 to 1.6, and initial temperatures of 328, 353, and 428 K. To further investigate the relationship between the molecular structure and laminar burning velocity, identical experiments were also performed for binary mixtures of cyclopentanone with ethanol and n-propanol at 1:1 (mol). The consistency between the experimental data sets obtained in this work and literature data sets has been evaluated. Here, a recently published mechanism of cyclopentanone was used for simulation after adopting the submechanism of n-propanol. Good agreement has been seen between experimental and simulated results for all flames. To qualitatively explain the characteristics of the laminar burning velocity of cyclopentanone and the differences with those of ethanol and n-propanol, sensitivity analysis and reaction pathway analysis have been performed to compare the chemistry of the fuels under flame conditions, which revealed how the molecular structure of cyclopentanone could affect its laminar burning velocity. Compared to ethanol and n-propanol, cyclopentanone does not have primary carbon atoms in its molecule, leading to lower production of methyl radicals. Meanwhile, the carbonyl group in the cyclopentanone molecule is mostly released as CO in the decomposition of multiple intermediates accompanied by the production of unsaturated C 2 and C 4 species, especially C 2 H 4 and C 2 H 3 . Both features contribute to the high laminar burning velocity of cyclopentanone.

09 BIOMASS FUELS↗

DOE OSTI2023

Incentivizing Cold-Climate Efficiency in Juneau (Final Report)

This is the final technical report for the DOE EERE BTO project Incentivizing Cold-Climate Efficiency in Juneau. The project implemented a community energy campaign to deploy heat pumps and efficiency for residents of Juneau, in Southeast Alaska. The project helped Juneau make progress towards its renewable energy goal of reaching 80% renewable energy for space heating by 2045. The Incentivizing Cold-Climate Efficiency in Juneau (ICE-Juneau) project began in 2020 and concluded three years later in 2023. During that time, a group of implementation partners and a research advisory team instituted a beneficial electrification campaign to promote energy savings and carbon reduction in residences of Juneau, Alaska. The campaign, Thermalize Juneau, focused on the installation of single head ductless mini-split heat pumps along with other efficiency upgrades. Thermalize Juneau was the first campaign of its kind in Alaska. After several months of planning, registration opened to the public in early 2021, and over the course of six months 164 participants enrolled. Campaign staff provided education to homeowners on heat pumps and efficiency, and each participant received a one-on-one heat pump assessment using a custom Microsoft Excel-based calculator that estimated energy savings for their residence based on building characteristics and past utility bills. Participants could also obtain a free energy audit from one of the two local energy auditors to further inform their decision. A heat pump installer, electrician, and builder were selected via a competitive RFP process. Participants who felt ready to install a heat pump or other efficiency upgrades received a site visit and custom quote from each of these contractors free of charge, and if they still felt energy upgrades were right for them, could move forward with an individual contract. Participants received a $400 heat pump installation rebate, offered by the installer if 40 heat pump installations occurred through the campaign. Overall, the campaign facilitated 75 heat pump installations (including participants that went with another contractor or heat pump model) and 30 efficiency upgrades (including participants that went with another builder or did DIY upgrades). The campaign created 3 new jobs as the heat pump installer hired an administrative assistant and two apprentices over the course of the campaign. It also helped Juneau work toward achieving its renewable energy goal of 80% renewable energy for space heating by 2045 by upgrading houses from fuel oil to heat pumps powered by the hydropower electric grid. Researchers conducted four surveys to inform Thermalize Juneau and future energy campaigns. The first surveyed existing and prospective heat pump owners in Juneau to identify barriers the campaign could address and inform recruitment efforts. Entry and exit surveys provided information on participant demographics, goals, outcomes, and suggestions for improving future campaigns. And a final survey of community members who had not participated in Thermalize Juneau gave insight on ways future campaigns could include a greater diversity of participants so they could realize similar benefits. Researchers also used pre-campaign energy modeling to predict energy savings, which was then compared to the savings estimated through aggregation of heat pump assessments and energy audits, and later to actual energy savings of 10 participants who installed a heat pump and were able to provide complete energy use data sets. In addition to energy savings, and to assist the electric utility in future planning efforts, researchers analyzed the overall change in electric use across participants with energy data and heat pump installations. They also completed a life cycle cost analysis, showing positive net present values for those displacing a fuel oil appliance, and a more mixed case for those switching from electric baseboard. This project proved the feasibility of energy campaigns, with a goal of beneficial electrification, in cold, remote locations. The Thermalize Juneau team compiled a Guidebook to Thermalize Campaigns, available online. In addition to documenting what occurred in Alaska’s first thermalize campaign, it provides tips and resources for other communities wishing to implement a similar program.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

NASA NTRS1987

Fuel penalties and time flexibility of 4D flight profiles under mismodeled wind conditions

A parametric sensitivity study was conducted to evaluate time flexibility and fuel penalties associated with 4D operations in the presence of mismodeled wind. The final cruise and descent segments of a flight in an advanced time-metered air traffic control environment were considered. Optimal performance of a B-737-100 airplane in known, constant winds was determined. Performance in mismodeled wind was obtained by tracking no-wind reference profiles in the presence of actual winds. The results of the analysis are presented in terms of loss of time flexibility and fuel penalties compared to the optimum performance in modeled winds.

Williams, David H.↗

NASA NTRS1992

Effect of model selection on combustor performance and stability predictions using ROCCID

The ROCket Combustor Interactive Design (ROCCID) methodology is an interactive computer program that combines previously developed combustion analysis models to calculate the combustion performance and stability of liquid rocket engines. Test data from 213 kN (48,000 lbf) Liquid Oxygen (LOX)/RP-1 combustor with an O-F-O (oxidizer-fuel-oxidizer) triplet injector were used to characterize the predictive capabilities of the ROCCID analysis models for this injector/propellant configuration. Thirteen combustion performance and stability models were incorporated into ROCCID, and ten of them, which have options for triplet injectors, were examined. Calculations using different combinations of analysis models, with little or no anchoring, were carried out on a test matrix of operating combinations matching those of the test program. Results of the computer analyses were compared to test data, and the ability of the model combinations to correctly predict combustion stability or instability was determined. For the best model combination(s), sensitivity of the calculations to fuel drop size and mixing efficiency was examined. Error in the stability calculations due to uncertainty in the pressure interaction index (N) was examined. The recommended model combinations for this O-F-O triplet LOX/RP-1 configuration are proposed.

Giuliani, James E.↗