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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 1,711 records · Page 95
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

System and method for temperature control in an oxygen transport membrane based reactor

A system and method for temperature control in an oxygen transport membrane based reactor is provided. The system and method involves introducing a specific quantity of cooling air or trim air in between stages in a multistage oxygen transport membrane based reactor or furnace to maintain generally consistent surface temperatures of the oxygen transport membrane elements and associated reactors. The associated reactors may include reforming reactors, boilers or process gas heaters.

03 NATURAL GAS↗
DOE OSTI2019

MODELING AND SIMULATIONS OF DETERIORATED TURBULENT HEAT TRANSFER IN WALL HEATED CYLINDRICAL TUBE

The paper discusses the modeling and simulations of Deteriorated Turbulent Heat Transfer (DTHT) for a wall-heated fluid flows, which can be observed in gas-cooled nuclear power reactors during Pressurized Conduction Cooldown (PCC) event due to loss of force circulation flow. The DTHT regime is defined as the deterioration of normal turbulent heat transport due to increase of acceleration and buoyancy forces. The Computational Fluid Dynamics (CFD) tools such as Nek5000 and STAR-CCM+ can help to analyze the DTHT phenomena in reactors for efficient thermal-fluid designs. 3D CFD non-isothermal modeling and simulations were performed in a wall-heated circular tube. The simulation results were verified with two different CFD tools, Nek5000 and STAR-CCM+, and validated with an experimental data. The predicted bulk temperatures were identical in both CFD tools, as expected. Good agreement between simulated results and measured data were obtained for wall temperatures along the tube axis using Nek5000. In STAR-CCM+, the under-predicted wall temperatures were mainly due to higher turbulence in the wall region. In STAR-CCM+, the predicted DTHT was over 48% at outlet when compared to inlet heat transfer values.

deteriorated turbulent heat transfer↗
DOE OSTI2022

Creep and cascade failure mitigation in heat pipe reactors

Technique(s) to mitigate creep and/or cascade failure in high temperature heat pipe reactor cores may include gas loading each heat pipe such that when one or more heat pipes in the heat pipe array fail, the adjacent heat pipes can accommodate added heat load with little change in temperature.

Reid, Robert Stowers↗
DOE OSTI2019

YRA poster session - July 25 2019

The poster presents the results of the current research activities I am carrying on for the verification and validation of the MOOSE based code Pronghorn.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2023

2.2.3.106 - Lignin-First Biorefinery Development

The Lignin-First Biorefinery Development (LigFirst) project aims to develop a cost-effective, and scalable biomass fractionation strategy based on reductive catalytic fractionation (RCF). The RCF process uses a protic solvent, hydrogen gas or a hydrogen donor, and a metal catalyst in the presence of intact biomass to produce a stable, depolymerized lignin oil and a polysaccharide pulp, which can both be converted to value-added products in parallel processes. RCF is a promising strategy to enable the use of woody feedstocks in biochemical conversion processes and is also promising as a means to valorize lignin with equal emphasis to biomass carbohydrates. Guided by techno-economic analysis and life cycle assessment and in collaboration with industry partners, we are actively developing RCF methods to 1) avoid the need for exogenous hydrogen gas, 2) substantially reduce reactor pressure via use of low vapor pressure solvents, 3) separate the lignin solvolysis and catalytic processes through reaction engineering solutions, 4) reduce solvent loading below what can be achieved in typical batch reactors, and 5) avoid or minimize the use of organic solvents. The LigFirst project also collaborates closely with the Lignin Utilization and Lignin Conversion-to-SAF projects for critical substrate handoffs and analytics. Overall, the LigFirst project is enabling new approaches that ultimately can enable RCF to be a feedstock-agnostic method to valorize both polysaccharides and lignin.

BIOMASS FUELS↗
DOE OSTI2016

Adsorption and Transport Properties of Zeolite SAPO-34 for Krypton/Xenon Separations

Nuclear power is an economical means of providing carbon-free energy, but requires effective ways to deal with the radioactive waste products. As part of the overall process for recycling used nuclear fuel (UNF), it is necessary to develop technologies to separate the off-gases formed during the fission of uranium and plutonium in nuclear power reactors. The off-gas contains {sup 129}I (radioisotope), NO, NO{sub 2}, CO{sub 2} containing {sup 14}C (radioisotope), {sup 3}H{sub 2}O (radioactive tritium oxide), {sup 85}Kr (radioisotope), and {sup 136}Xe. Separating and capturing each gas is essential to reduce the volume of radioactive waste for storage. Currently there exist economical technologies to separate {sup 129}I and {sup 14}CO{sub 2}. However, Kr and Xe separation is challenging because they are chemically inert and physically very similar. The Kr/Xe mixture is approximately 10/90 by volume and hence the separation of Kr would reduce the volume of radioactive {sup 85}Kr waste by a factor of 10. One way of separating them is by cryogenic distillation wherein they are condensed out as pure streams at very low temperature (Kr boiling point: -153 deg. C, Xe: -108 deg. C). Cryogenic distillation has intensive power requirements and a large system volume, resulting in high capital, operating, and disposal costs. Membrane-based separation using radiation-stable materials such as nanoporous zeolites is an attractive alternative, if membranes with sufficient Kr flux and selectivity can be fabricated. An ideal membrane process would permeate a stream of pure Kr for storage and also produce a retentate of pure Xe which has commercial value (> $8/g at 99+% purity from Airgas{sup R}). Zeolites are nanoporous crystalline aluminosilicate materials with pores that are capable of separating molecules by shape and size. SAPO-34 is a silicoaluminophosphate zeolite with pore size of 0.38 nm. The SAPO-34 is a molecular sieve composed of 3D networks with CHA frame structure containing uniform micropores. Since this pore size is intermediate between the kinetic diameters of krypton (0.36 nm) and xenon (0.396 nm), it was hypothesized that SAPO-34 membranes can separate krypton and xenon by diffusivity differences. Previously we fabricated SAPO-34 membranes and showed that they are capable of separating Kr from Xe. Here we describe a more detailed study of the fundamental adsorption and transport properties of SAPO34. In particular, the permeabilities of Kr and Xe in SAPO-34 are dependent on both their adsorption and diffusion characteristics in the nanoporous zeolite. Typically, nanoporous materials show stronger adsorption of Xe than Kr (due to stronger van der Waals forces) but faster diffusion of Kr (due to smaller kinetic diameter). Therefore the overall membrane selectivity towards Kr will be determined by competition between these two effects. A main objective of this study is to quantify and understand adsorption, diffusion, and permeation in detail and thereby obtain: (1) fundamental parameters useful for design calculations of a Kr/Xe separation membrane process, and (2) an experimental and modeling framework that can provide guidance on the expected limits of performance of SAPO-34 and other zeolite materials. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2017

Chabazite Zeolite Membranes for Krypton/Xenon Separation: Control of Membrane Properties and Process Modeling

Nuclear energy is considered to be a clean and economical means of carbon-free energy. As part of the overall process for recycling used nuclear fuel (UNF), it is necessary to develop technologies to separate the off-gases formed during the fission of uranium and plutonium in nuclear power reactors. The off-gas stream is generated during the shearing and chopping, voloxidation, and acid dissolution steps, and would have a flow rate of ∼2500 L/min assuming a typical 800 tons heavy metal/yr reprocessing facility. Kr separation from Xe is one of the steps in a proposed UNF off-gas processing flowsheet. The Kr/Xe mixture is approximately 10/90 by volume and hence the separation of Kr would reduce the volume of radioactive {sup 85}Kr waste by a factor of 10. Kr/Xe separation is challenging since they are both chemically inert species and physically very similar (0.036 nm size difference). There is no existing process for this separation that is suitable for use in UNF recycling since conventional cryogenic distillation requires highly intensive power and large system volume. Membrane-based separation using radiation-stable materials such as zeolites could be an attractive separation method, if membranes with sufficient Kr flux and selectivity can be fabricated. Zeolite membranes offer an opportunity to exploit the size difference of Kr (kinetic diameter 0.36 nm) and Xe (0.396 nm) to achieve preferential permeation of the minority component (Kr) from the mixture, leading to an efficient separation with very low energy requirements. An ideal membrane process would permeate a stream of pure Kr for storage and also produce pure Xe which has commercial value (> $8000/kg at 99+% purity). SAPO-34 is a silico-alumino-phosphate zeolite molecular sieve with CHA framework topology and containing uniform micropores (0.38 nm), intermediate in size between the kinetic diameters of Kr and Xe. It was hypothesized that SAPO-34 membranes can separate krypton and xenon by diffusivity differences. Previously we fabricated SAPO-34 membranes and showed that they are capable of separating Kr from Xe. Our previous work also indicated that there is much potential for engineering the separation properties of these membranes with a view to improving permeance and selectivity and evaluating the expected process performance. The main objectives of the present study are: 1) development of SAPO-34 membranes with enhanced membrane performance via thickness reduction and ion exchange, and 2) process modeling for technic-economic analysis of zeolite membrane systems for Kr/Xe separation.

36 MATERIALS SCIENCE↗
DOE OSTI2025

FIDES-II/P2M Simulation Exercise on AN3 and AN10 bump tests: main results

This paper presents simulations of bump tests conducted as part of the P2M (Power to Melt and Maneuverability) project within the OECD/NEA FIDES-II framework (Framework for Irradiation Experiments). To prepare fuel performance codes for analyzing the P2M experiments, an international Simulation Exercise (SE) was initiated under the P2M project. The objective of this exercise was to model the AN3 and AN10 bump tests carried out in the 1980s at the DR3 reactor (3rd RISØ Fission Gas Project), during which instrumented fuel rodlets (equipped with thermocouples and pressure sensors) were subjected to prolonged power transients and power dips. The ongoing simulation exercise involves seven organizations from industry, research, and regulatory bodies, each using different fuel performance codes. This paper provides detailed descriptions of the test cases and simulation results from six fuel performance codes (ALCYONE, BISON, FAST, FEMAXI, FRAPCON, and TRANSURANUS), with a particular focus on fission gas release kinetics.

11 - NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2023

Machine learning-based ethylene and carbon monoxide estimation, real-time optimization, and multivariable feedback control of an experimental electrochemical reactor

Electrochemical reduction of CO 2 gas is a novel CO 2 utilization technique that has the potential to mitigate the global climate crisis caused by anthropogenic CO 2 emissions, and enable the large-scale storage of energy generated from renewable sources in the form of carbon-based chemicals and fuels. However, due to the complexity of the electrochemical reactions, the explicit first-principles models for CO2 reduction are not available yet, and there has been a limited effort to develop process modeling, optimization and control of CO 2 electrochemical reactors. To this end, a rotating cylinder electrode (RCE) reactor has been constructed at UCLA to understand the mass transfer and reaction kinetics effects separately on the productivity. In the RCE reactor, the applied potential strongly influences the reaction energetics and the electrode rotation speed affects the hydrodynamic boundary layer and modifies the film mass transfer coefficient, which involves convective and diffusive transport. Further, the present work aims to develop a multi-input multi-output (MIMO) control scheme for the RCE reactor that integrates techniques from artificial and recurrent neural network modeling, nonlinear optimization, and process controller design. Specifically, production rates of two products from the experimental reactor, ethylene and carbon monoxide, are controlled by manipulating two inputs, applied potential and catalyst rotation speed. Process dynamics and controllability are analyzed, a feedback control strategy is designed and the controllers are tuned accordingly. The experimental electrochemical cell is employed to gather data for process modeling and implement the multivariable control system. Finally, the experimental results are presented which demonstrate excellent closed-loop performance by the control system and regulation of the outputs at three different set-points including an economically-optimal set-point.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2017

Assessment of MELCOR condensation models with the presence of noncondensable gas in natural convection flow regime

Condensation of steam vapor is an important mode of energy removal from the reactor containment. The presence of noncondensable gas complicates the process and makes it difficult to model. MELCOR, one of the more widely used system codes for containment analyses, uses the heat and mass transfer analogy to model condensation heat transfer. To investigate previously reported nodalization-dependence in natural convection flow regime, MELCOR condensation model as well as other models are studied. The nodalization-dependence issue is resolved by using physical length from the actual geometry rather than node size of each control volume as the characteristic length scale for MELCOR containment analyses. At the transition to turbulent natural convection regime, the McAdams correlation for convective heat transfer produces a better prediction compared to the original MELCOR model. The McAdams correlation is implemented in MELCOR and the prediction is validated against a set of experiments on a scaled AP600 containment. The MELCOR with our implemented model produces improved predictions. For steam molar fractions in the gas mixture greater than about 0.58, the predictions are within the uncertainty margin of the measurements. The simulation results still underestimate the heat transfer from the gas-steam mixture, implying that conservative predictions are provided.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
NASA NTRS1979

Gas phase oxidation downstream of a catalytic combustor

Effect of the length available for gas-phase reactions downstream of the catalytic reactor on the emission of CO and unburned hydrocarbons was investigated. A premixed, prevaporized propane/air feed to a 12/cm/diameter catalytic/reactor test section was used. The catalytic reactor was made of four 2.5 cm long monolithic catalyst elements. Four water cooled gas sampling probes were located at positions between 0 and 22 cm downstream of the catalytic reactor. Measurements of unburned hydrocarbon, CO, and CO2 were made. Tests were performed with an inlet air temperature of 800 K, a reference velocity of 10 m/s, pressures of 3 and 600,000 Pa, and fuel air equivalence ratios of 0.14 to 0.24. For very lean mixtures, hydrocarbon emissions were high and CO continued to be formed downstream of the catalytic reactor. At the highest equivalence ratios tested, hydrocarbon levels were much lower and CO was oxidized to CO2 in the gas phase downstream. To achieve acceptable emissions, a downstream region several times longer than the catalytic reactor could be required.

Tien, J. S.↗
DOE OSTI2020

TChem v2.0 - A Software Toolkit for the Analysis of Complex Kinetic Models

TChem is an open source software library for solving complex computational chemistry problems and analyzing detailed chemical kinetic models. The software provides support for: complex kinetic models for gas-phase and surface chemistry; thermodynamic properties based on NASA polynomials; species production/consumption rates; stable time integrator for solving stiff time ordinary differential equations; and, reactor models such as homogenous gas-phase ignition (with analytical Jacobian matrices), continuously stirred tank reactor, plug-flow reactor. This toolkit builds upon earlier versions that were written in C and featured tools for gas-phase chemistry only. The current version of the software was completely refactored in C++, uses an object-oriented programming model, and adopts Kokkos as its portability layer to make it ready for the next generation computing architectures i.e., multi/many core computing platforms with GPU accelerators. We have expanded the range of kinetic models to include surface chemistry and have added examples pertaining to Continuously Stirred Tank Reactors (CSTR) and Plug Flow Reactor (PFR) models to complement the homogenous ignition examples present in the earlier versions. To exploit the massive parallelism available from modern computing platforms, the current software interface is designed to evaluate samples in parallel, which enables large scale parametric studies, e.g. for sensitivity analysis and model calibration.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS2005

A Theoretical Investigation of Oxidation Efficiency of a Volatile Removal Assembly Reactor Under Microgravity Conditions

Volatile Removal Assembly (VRA) is a subsystem of the Closed Environment Life Support System (CELSS) installed in the International Space Station. It is used for removing contaminants (volatile organics) in the wastewater produced by the space station crews. The major contaminants are formic acid, ethanol, and propylene glycol. The VRA contains a slim packbed reactor (3.5 cm diameter and four 28 cm long tubes in series) to perform catalyst oxidation of wastewater at elevated pressure and temperature under microgravity conditions. In the reactor, the contaminants are burned with oxygen gas (O2) to form water and carbon dioxide (CO2) that dissolves in the water stream. Optimal design of the reactor requires a thorough understanding about how the reactor performs under microgravity conditions. The objective of this study was to develop a mathematical model to interpret experimental data obtained from normal and microgravity conditions, and to predict the performance of VRA reactor under microgravity conditions. Catalyst oxidation kinetics and the total oxygen-water contact area control the efficiency of catalyst oxidation for mass transfer, which depends on oxygen gas holdup and distribution in the reactor. The process involves bubbly flow in porous media with chemical reactions in microgravity environment. This presents a unique problem in fluid dynamics that has not been studied. Guo et al. (2004) developed a mathematical model that predicts oxygen holdup in the VRA reactor. No mathematical model has been found in the literature that can be used to predict the efficiency of catalyst oxidation under microgravity conditions.

Guo, Boyun↗
DOE OSTI2013

Hydrogasification reactor and method of operating same

The present invention provides a system and method for evaluating effects of process parameters on hydrogasification processes. The system includes a hydrogasification reactor, a pressurized feed system, a hopper system, a hydrogen gas source, and a carrier gas source. Pressurized carbonaceous material, such as coal, is fed to the reactor using the carrier gas and reacted with hydrogen to produce natural gas.

03 NATURAL GAS↗
DOE OSTI2022

Design of a Combined Proportional Integral Derivative Controller to Regulate the Temperature Inside a High-Temperature Tubular Solar Reactor

Solar fuels are proven to be promising candidates for thermochemical energy storage. However, the transient nature of solar radiation is an obstacle to maintaining a stable operational temperature inside a solar reactor. To overcome this challenge, the temperature of a solar reactor can be regulated by controlling the incoming solar radiation or the feedstock flowrate inside the reactor. In this work, a combined proportional integral derivative (PID) controller is implemented to regulate the temperature inside a high-temperature tubular solar reactor with counter-current flowing gas/particles. The control model incorporates two control systems to regulate incoming solar radiation and gas flow simultaneously. The design of the controller is based on a reduced-order numerical model of a high-temperature tubular solar reactor that is vertically oriented with an upward gas flow and downward particle flow. The reactor receives heat circumferentially through its wall over a finite segment of its length. Formulation of the heat transfer model is presented by applying the energy balance for the reactor tube and considering heat and mass transfer inside. A set of governing differential equations are solved numerically by using the finite volume method to obtain reactor wall, particles, and gas temperatures along the reactor length with various boundary conditions. Simulation results are used to tune the PID controller parameters by utilizing the Ziegler–Nichols tuning method. Both the simulation results and the controller performance are visualized on the LABVIEW platform. The controller is challenged to track different temperature setpoints with different scenarios of transient solar radiation. Here, the performance of the PID controller was compared to experimental results obtained from an industrial PID controller embedded in a 7 kW electric furnace. Results show that the combined PID controller is successful in maintaining a stable temperature inside the reactor by regulating the incoming solar radiation and the flowrate via small steady-state error and reasonable settling time and overshoot.

14 SOLAR ENERGY↗
DOE OSTI2018

Numerical Simulation of Recirculating Flow and Physical Model of Slag–Metal Behavior in an RH Reactor: Application to Desulfurization

Computational fluid dynamics (CFD) techniques and a 1:7.5 physical model of an RH degasser have been used to evaluate the flow of gas and metal inside an RH reactor for vacuum degassing of liquid steel. The effect of gas injection on the gas spatial distribution, steel circulation rate and flow field inside the ladle, snorkels and vacuum chamber have been assessed. N-pentane oil was employed to evaluate the average residence time as well as the slag droplet size distribution. The predicted radial gas distribution and liquid circulation rate have been validated against experimental data from a physical model. The results with incorporation of the virtual mass force coefficient of 0.25 and the turbulence dispersion force showed better predictions of gas distribution in the up-snorkel as well as circulation rate. Full-scale simulations were performed, and the predicted circulation rate was significantly affected by the argon bubble expansion. Data from these simulations were used to analyze the degree of desulfurization performed by the addition of desulfurizing agents inside the vacuum chamber. A model of the kinetics of desulfurization based on the results from the physical model and CFD simulation and on slag dispersion inside liquid steel yields degrees of desulfurization similar to the industrial trials reported in the literature.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Quantification of gas emissions from stored softwood chips as solid biofuels

Western Red Cedar (WRC) is one of the abundant softwood species, which is considered as a good source of biofuel. This paper aims at quantifying gas emissions from stored WRC woodchips and studying the potential health impact during storage and transportation. Experiments were conducted using lab-scale reactors for a range of temperatures under both non-aerobic and aerobic conditions depending on oxygen level. Results from tests using non-aerobic reactors showed that the highest carbon dioxide emission factor of 2.8 g/kg dry matter (DM) was observed at 20 A degrees C for a storage period of 2 months. Although the carbon monoxide emission factor was much lower at 0.03 g/kg DM, it increased with increasing temperatures due to chemical oxidation. Carbon dioxide and carbon monoxide emissions from the aerobic reactors exhibited similar trends as the non-aerobic reactors with respect to the effect of temperature. Total gas emissions were higher from the aerobic reactors compared with those from non-aerobic reactors. Results from the qualitative gas chromatography-mass spectrometry analysis indicated a range of volatile organic compounds was emitted from the stored WRC woodchips. Some of these volatile organic compounds might be associated with the characteristic pungent smell of WRC which could cause odor nuisance to the neighboring community. Here, the total volatile organic compounds concentration was found to be positively correlated with temperature. At the end of the storage period, percent DM loss was below 1 % for both the non-aerobic and aerobic reactors, reaffirming the decay-resistance characteristics of WRC.

09 BIOMASS FUELS↗