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At least 1,765 records · Page 98

Mathematical Modeling of Decarburization in Levitated Fe-Cr-C Droplets

Using carbon dioxide to replace oxygen as an alternative oxidant gas has proven to be a viable solution in the decarburization process, with potential for industrial applications. In a recent study, the transport phenomena governing the carbon dioxide decarburization process through the use of electromagnetic levitation (EML) was examined. CO{sub 2}/CO mass transfer was found to be the principal reaction rate control step, as a result gas diffusion has gained significant attention. In the present study, gas diffusion during decarburization process was investigated using computational fluid dynamics (CFD) modeling coupled with chemical reactions. The resulting model was verified through experimental data in a published paper, and employed to provide insights on phenomena typically unobservable through experiments. Based on the results, a new correction of the Frössling equation was presented which better represents the mass transfer phenomena at the metal-gas interface within the range of this research.

36 MATERIALS SCIENCE↗

Laboratory Constraints on the Stability of Petroleum at Elevated Temperatures: Implications for the Origin of Natural Gas

Results of prior DOE supported research conducted at the Woods Hole Oceanographic Institution have demonstrated the participation of sedimentary minerals and water as reactants and catalysts in chemical transformations associated with the degradation of oil and the formation of low molecular weight organic compounds. The occurrence of such processes in natural environments can be difficult to recognize because the composition of organic alteration products may not be substantially different than those produced by thermal cracking. The goals of this study were the development of diagnostic tools based on hydrogen and carbon isotopes that can be used to identify geochemical processes responsible for the formation of thermogenic natural gas. In addition, our activities were expanded to include experimental investigation of CO2 reduction in aqueous systems at elevated temperature and pressures and an assessment of microbial activity in relatively low temperature (<70°C) natural gas reservoirs in southeastern Oklahoma. Specific objectives included: A laboratory investigation of geochemical processes that regulate the hydrogen isotope composition of low molecular weight hydrocarbons in natural gas at elevated temperatures and pressures. A laboratory investigation of factors that regulate the carbon isotope composition of organic acids in basinal brines. A laboratory assessment of the role of methanol during reduction of CO2 to CH4 under hydrothermal conditions. Characterization of microbial ecosystems in coproduced fluids from the Potato Hills gas field to assess the role of microbes in the generation of natural gas.

02 PETROLEUM↗

Adsorption of iodine on hydrogen-reduced silver-exchanged mordenite: Experiments and modeling

The adsorption process of iodine, a major volatile radionuclide in the off-gas streams of spent nuclear fuel reprocessing, on hydrogen-reduced silver-exchanged mordenite (Ag 0 Z) was studied at the micro-scale. The gas-solid mass transfer and reaction involved in the adsorption process were investigated and evaluated with appropriate models. Optimal conditions for reducing the silver-exchanged mordenite (AgZ) in a hydrogen stream were determined. Kinetic and equilibrium data of iodine adsorption on Ag 0 Z were obtained by performing single-layer adsorption experiments with experimental systems of high precision at 373–473 K over various iodine concentrations. Results indicate approximately 91% to 97% of the iodine adsorption was through the silver-iodine reaction. The effect of temperature on the iodine loading capacity of Ag 0 Z was discussed. In conclusion, the Shrinking Core model describes the data well, and the primary rate controlling mechanisms were macro-pore diffusion and silver-iodine reaction. © 2016 American Institute of Chemical Engineers AIChE J, 2016

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

Lidar-based remote infrared gas sensor for monitoring anthropogenic pollution: a proof of concept

We propose using wavelength-modulation laser absorption spectroscopy in combination with quadrature detection of scattered light for remote industrial pollution monitoring in the atmosphere with a compact lidar-based gas sensor, which can be mounted on board an unmanned aerial vehicle. The instrument can be used for detecting leaks in product pipe lines; monitoring toxic gases near landfill sites, waste incineration plants, and other hazardous man-made facilities; analysing the gas atmosphere in industrial buildings and structures; and monitoring engineering processes at a sensitivity level of tens of ppm m in gas concentration measurements at characteristic distances of tens of metres. (laser applications and other issues in quantum electronics)

42 ENGINEERING↗

Spherical flame characteristics of heptane/iso-butanol mixture droplets

Experimental data and detailed numerical modelling are presented on the burning characteristics of a model gasoline/biofuel mixture consisting of n-heptane and iso-butanol. A droplet burning in an environment that minimises the influence of buoyant and forced convective flows in the standard atmosphere is used to promote one-dimensional gas transport to facilitate numerical modelling of the droplet burning process. The numerical model includes a detailed combustion kinetic mechanism, unsteady gas and liquid transport, multicomponent diffusion inside the droplet, variable properties, and non-luminous radiative heat transfer from the flame. The numerical simulation was validated by experimental measurements in the standard atmosphere which showed good agreement with the evolutions of droplet and flame diameters. The iso-butanol concentration had a strong effect on formation of particulates. Above ~20% (volume) iso-butanol, flame luminosity was significantly diminished anddecreased with increasing iso-butanol concentration, while CO2 emissions as a representative greenhouse gas were not strongly influenced by the iso-butanol loading. The soot shell was located near a 1350 K isotherm for concentrations up to 20% (volume) iso-butanol, suggesting this value as a possible soot inception temperature for the mixture droplet. The combustion rate decreased with increasing iso-butanol concentration which was attributed to iso-butanol's higher liquid density. No evidence of a low temperature burning regime, or of extinction, was found (in experiments and simulations) for the small droplet sizes investigated.

Dalili, Alireza↗

AGR-5/6/7 Fuel Fabrication, Process Documentation, and Disposition

The need for U. S. energy self-sufficiency dictates the development of new low-cost, environmentally-safe forms of energy generation, hydrogen production and industrial heat systems using high temperature gas-cooled reactor (HTGR) technology. Efficient fabrication of ultra-high quality, coated particle fuel is a central requirement for implementing gas reactor technology. Babcock & Wilcox Nuclear Operations Group-Lynchburg (B&W NOG-L) is uniquely qualified in the U.S. with the institutional knowledge, access to equipment, and a Nuclear Regulatory Commission (NRC) license to produce tristructural isotropic (TRISO) coated particle nuclear fuel above 5 wt% 235U. This Statement of Work (SOW) defines the Subcontractor, B&W NOG-L and identifies the work scope to perform Advanced Gas Reactor (AGR)-5/6/7 fuel fabrication, process documentation, and material disposition planning.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Interaction between phases in the liquid–gas system

This work analyzes the equilibrium between a liquid and a gas over this liquid separated by an interface. Various gas forms exist inside the liquid: dissolved gas molecules attached to solvent molecules, free gas molecules, and gaseous bubbles. Thermodynamic equilibrium is maintained between two phases; the first phase is the liquid containing dissolved and free molecules, and the second phase is the gas over the liquid and bubbles inside it. Kinetics of gas transition between the internal and external gas proceeds through bubbles and includes the processes of bubbles floating up and bubble growth as a result of association due to the Smoluchowski mechanism. Evolution of a gas in the liquid is considered using the example of oxygen in water, and numerical parameters of this system are given. In the regime under consideration for an oxygen–water system, transport of oxygen into the surrounding air proceeds through micron-size bubbles with lifetimes of hours. This regime is realized if the total number of oxygen molecules in water is small compared with the numbers of solvated and free molecules in the liquid.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Heterogeneity‐enhanced gas phase formation in shallow aquifers during leakage of CO 2 ‐saturated water from geologic sequestration sites

Abstract A primary concern for geologic carbon storage is the potential for leakage of stored carbon dioxide (CO 2 ) into the shallow subsurface where it could degrade the quality of groundwater and surface water. In order to predict and mitigate the potentially negative impacts of CO 2 leakage, it is important to understand the physical processes that CO 2 will undergo as it moves through naturally heterogeneous porous media formations. Previous studies have shown that heterogeneity can enhance the evolution of gas phase CO 2 in some cases, but the conditions under which this occurs have not yet been quantitatively defined, nor tested through laboratory experiments. This study quantitatively investigates the effects of geologic heterogeneity on the process of gas phase CO 2 evolution in shallow aquifers through an extensive set of experiments conducted in a column that was packed with layers of various test sands. Soil moisture sensors were utilized to observe the formation of gas phase near the porous media interfaces. Results indicate that the conditions under which heterogeneity controls gas phase evolution can be successfully predicted through analysis of simple parameters, including the dissolved CO 2 concentration in the flowing water, the distance between the heterogeneity and the leakage location, and some fundamental properties of the porous media. Results also show that interfaces where a less permeable material overlies a more permeable material affect gas phase evolution more significantly than interfaces with the opposite layering.

Plampin, Michelle R.↗

Extending TOUGH + HYDRATE with a parallel particle transport simulator: numerical investigation of sand production during gas production from hydrate deposits

A new parallel code for simulating particle transport in porous media is integrated with the TOUGH + HYDRATE simulator to investigate sand production associated with gas production from unconsolidated gas hydrate-bearing sediments (HBS). Here, the parallel coupled simulator is named THMPT and uses the integral finite difference method to describe the Darcian and non-Darcian flow of fluids and heat transport, the finite element method to describe the associated geomechanical changes, and the discrete element method to track the trajectory of individual sand particles within the HBS. The THMPT simulator is written in Fortran, incorporates multiple optimized algorithms, and can comprehensively address the coupled flow, thermal, chemical, geomechanical, and particle transport processes that characterize the system behaviors during gas production from HBS. The simulator can capture all processes involved in sand particle transport in porous media, including sand detachment, collision, clogging (i.e., bridging), and migration. A benchmark case study of sand production in the course of depressurization-induced gas production from a representative HBS reveals various distinct microscopic particle migration mechanisms and the adverse impact of sand particle detachment, transport, and clogging. The numerical investigation also examines the effect of bottomhole pressure on mitigating sand production. The simulation results indicate that sand clogging near the wellbore significantly reduces permeability, decreasing gas production by at least 50%. Lastly, the efficiency of gravel packing in mitigating sand production is numerically evaluated, revealing that the structure of the porous media appears to profoundly influence the macroscopic motion behavior of sand particles and sand clogging characteristics.

discrete element method↗

Spatially and temporally resolved plasma parameter estimations of laser heated MagLIF relevant gas pipes at NIF

The ability to control laser pre-heat is an integral part of the inertial confinement fusion concept known as Magnetized Liner Inertial Fusion. This process is studied at the National Ignition Facility (NIF) where 4 of the 192 laser beams are propagated through a 1-cm long gas cell where they deposit >20 kJ of energy into the gaseous fuel via inverse bremsstrahlung absorption. This process ionizes the gas, producing a plasma that follows behind the laser front and expands over the radius of the cell. Emission from this plasma, as viewed by a gated x-ray detector, can be used to build spatially and temporally resolved estimations of the pre-heat plasma's density and temperature profiles. This can then be used to estimate the plasma pressure, internal energy, and radiation losses. Estimations show the evolution of the plasma in magnetized and unmagnetized gas cells filled with ambient temperature neopentane (C5H12) +1% Ar, as well as unmagnetized cryogenically cooled (32 K) deuterium +1% Ne filled targets. This analysis shows the effects of initial gas-fill density, composition, and axial magnetization on the time-dependent plasma parameters. Previously, these parameters at the NIF had not been experimentally characterized, and these estimations provided a potential new means of testing radiation magneto-hydrodynamic predictive capability models. Results in unmagnetized targets have strong agreement with simulations. However, in targets with a 19 T applied axial magnetic field, this method yields electron temperatures up to 100% hotter than those predicted by HYDRA codes.

Bremsstrahlung↗

AGR-5/6/7 Fuel Fabrication, Process Documentation, and Disposition Planning

The need for U. S. energy self-sufficiency dictates the development of new low-cost, environmentally-safe forms of energy generation, hydrogen production and industrial heat systems using high temperature gas-cooled reactor (HTGR) technology. Efficient fabrication of ultra-high quality, coated particle fuel is a central requirement for implementing gas reactor technology. Babcock & Wilcox Nuclear Operations Group-Lynchburg (B&W NOG-L) is uniquely qualified in the U.S. with the institutional knowledge, access to equipment, and a Nuclear Regulatory Commission (NRC) license to produce tristructural isotropic (TRISO) coated particle nuclear fuel above 5 wt% 235U. This Statement of Work (SOW) defines the Subcontractor, B&W NOG-L and identifies the work scope to perform Advanced Gas Reactor (AGR)-5/6/7 fuel fabrication, process documentation, and material disposition planning.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Characterization of Thermal, Hydraulic, and Gas Diffusion Properties in Variably Saturated Sand Grades

Core Ideas This study provides physical, hydraulic, and thermal properties of five sand grades. An extended three‐region thermal conductivity model is proposed. A gas diffusivity‐based variable tortuosity parameter is examined. Useful parametric functions and descriptive models were tested. Detailed characterization of partially saturated porous media is important for understanding and predicting vadose zone transport processes. While basic properties (e.g., particle‐ and pore‐size distributions and soil‐water retention) are, in general, essential prerequisites for characterizing most porous media transport properties, key transport parameters such as thermal conductivity and gas diffusivity are particularly important to describe temperature‐induced heat transport and diffusion‐controlled gas transport processes, respectively. Despite many experimental and numerical studies focusing on a specific porous media characteristic, a single study presenting a wide range of important characteristics, together with the best‐performing functional relationships, can seldom be found. This study characterized five differently textured sand grades (Accusand no. 12/20, 20/30, 30/40, 40/50, and 50/70) in relation to physical properties, water retention, hydraulic conductivity, thermal conductivity, and gas diffusivity. We used measured basic properties and transport data to accurately parameterize the characteristic functions (particle‐ and pore‐size distributions and water retention) and descriptive transport models (thermal conductivity, saturated hydraulic conductivity, and gas diffusivity). An existing thermal conductivity model was improved to describe the distinct three‐region behavior in observed thermal conductivity–water saturation relations. Applying widely used parametric models for saturated hydraulic conductivity and soil‐gas diffusivity, we characterized porous media tortuosity in relation to grain size. Strong relations among average particle diameter, characteristic pore diameter from soil‐water retention measurements, and saturated hydraulic conductivity were found. Thus, the results of this work are useful toward better describing, linking, and predicting mass transfer and pore network properties in variably saturated porous media.

Chamindu Deepagoda, T. K. K.↗

Thermal Process Intensification: Transforming the Way Industry Uses Thermal Process Energy

The US Department of Energy’s (DOE’s) Advanced Manufacturing Office held the virtual workshop entitled “Thermal Process Intensification: Transforming the Way Industry Uses Thermal Process Energy” in November and December 2020. The workshop brought together participants from universities/laboratories, industries, equipment manufacturers, technology vendors, nongovernmental organizations, and subject-matter experts to discuss transformative technologies and strategies to substantially improve the performance (e.g., energy productivity, thermal efficiency, reduced greenhouse gas [GHG] emissions, reduced number of process steps) of thermal processing systems in the industrial sector.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Thermal Process Intensification: Transforming the Way Industry Uses Thermal Process Energy (Workshop Report)

The US Department of Energy’s (DOE’s) Advanced Manufacturing Office held the virtual workshop entitled “Thermal Process Intensification: Transforming the Way Industry Uses Thermal Process Energy” in November and December 2020. The workshop brought together participants from universities/laboratories, industries, equipment manufacturers, technology vendors, nongovernmental organizations, and subject-matter experts to discuss transformative technologies and strategies to substantially improve the performance (e.g., energy productivity, thermal efficiency, reduced greenhouse gas [GHG] emissions, reduced number of process steps) of thermal processing systems in the industrial sector. The US industrial sector accounts for 32% of the nation’s primary energy use (including feedstocks), and refining, chemicals, pulp and paper, iron and steel, and food products represent the top energy-consuming sectors. Thermal processing or process heating represents the largest energy use category; it accounts for 63% of all energy use in manufacturing. Additionally, thermal processing is the largest contributor of carbon dioxide (CO2) generation, resulting from combustion of fuels and process related chemical reactions, such as in the case of cement and lime production. The challenge of achieving net-zero industrial GHG emissions is colossal considering the established industrial base that depends mainly on carbon-based processes and energy sources; the time frame and cost to replace carbon-based energy sources and feedstocks; and the long-term outlook for development with large-scale adaptation of alternative non carbon–based technologies. The goals of the DOE Advanced Manufacturing Office Thermal Process Intensification Workshop were as follows: (1) Identify R&D gaps and opportunities to facilitate transformative improvement in industrial thermal processes beyond current technologies and allow for entirely new methods for processing materials; (2) Gain insight into new and innovative approaches to thermally intensify processes, reduce heat demand, harness waste heat, and use fuels and hydrocarbon feedstocks more efficiently; (3) Identify the R&D pathways to thermal process intensification (TPI) with the highest potential for impact and adoption by the industrial sector; (4) Define areas of research, development, and demonstration (RD&D) activities to accelerate development and application of emerging and transformative technologies to intensify thermal processes in industry. The scope and focus of the workshop were defined to meet these goals. Based on the available data for energy use and GHG emissions, the industries that collectively use more than 80% of the total process heating energy consumption were selected as primary focus areas. The chosen industries were combined into the following four groups based on similarities in their thermal processes: high-temperature metal processing (iron and steel industry, alumina-aluminum industry); high-temperature nonmetal and mineral processing (cement and glass industry); medium- to low-temperature thermal processing (food processing and pulp and paper industry as part of forest products sector); and hydrocarbon processing (petroleum refining and chemical industry). Furthermore, all potential TPI technologies associated with the processes defined were considered as part of the workshop. Different types of TPI technologies possible in industrial in the document.

42 ENGINEERING↗

Investigation of continuous carbothermal reduction of magnesia by magnesium vapor condensation onto a moving bed of solid particles

Magnesium metal production by carbothermic reduction (CTR) can reduce process emissions and energy requirements relative to silicothermic or electrolytic production, if high magnesium metal yields are achieved. A novel process was investigated where product magnesium gas condensed onto a moving bed of solid particles at high temperatures (≥300 °C) and in vacuum to minimize reversion and promote crystal growth. Using a half-system in which CTR product gases were artificially generated, magnesium continuously condensed onto steel, oxide, or carbide particles at yields >85% for P Mg = 0.5 kPa. Steel particles exhibited the greatest bed retention and ease of separation, so this medium was used for scale-up to a full-system in which MgO CTR in a fixed bed gasifier at 1400 °C–1550 °C produced Mg (g) and CO. The initial reduction resulted in high Mg yield (>80%), but yield decreased as the reaction proceeded. The accumulation of Mg (s) and reversion product in the condenser promoted further reversion. The process yield could likely be improved by using high surface area particles to promote heat and mass transfer, allowing for shorter solid and gas residence times in the condenser. A finite volume model on the reactor tube and pellet bed described the kinetics, heat transfer, and mass transfer phenomena in the reduction reactor. The model predicted that the center of the bed was >50 °C cooler than the furnace, and the product gas pressures were near equilibrium. A wide, directly heated reactor could overcome these heat and mass transfer limitations.

42 ENGINEERING↗

Process assessment of small scale low temperature methanol synthesis

Biomass is a renewable energy resource and has the potential to make a significant impact on domestic fuel supplies. Biomass can be converted to fuel like methanol via several step process. The process can be split into following main steps: biomass preparation, gasification, gas cooling and cleaning, gas shift and methanol synthesis. Untill now these configuration still has a problem like high production cost, catalyst deactivation, economy of scale and a huge energy requirements. These problems become the leading inhibition for biomass conversion to methanol, which should be resolved to move towards the economical. To address these issues, we developed various process and new configurations for methanol synthesis via methyl formate. This configuration combining two reactors: the one reactor for the carbonylation of methanol and CO to form methyl formate, and the second for the hydrogenolysis of methyl formate and H{sub 2} to form two molecule of methanol. Four plant process configurations were compared with the biomass basis is 300 ton/day. The first configuration (A) is equipped with a steam reforming process for converting methane to CO and H{sub 2} for increasing H{sub 2}/CO ratio. CO{sub 2} removal is necessary to avoid poisoning the catalyst. COSORB process used for the purpose of increasing the partial pressure of CO in the feed gas. The steam reforming process in B configuration is not used with the aim of reducing the number of process equipment, so expect lower investment costs. For C configuration, the steam reforming process and COSORB are not used with the aim of reducing the number of process equipment, so expect lower investment costs. D configuration is almost similar to the configuration A. This configuration difference is in the synthesis of methanol which was held in a single reactor. Carbonylation and hydrogenolysis reactions carried out in the same reactor one. These processes were analyzed in term of technical process, material and energy balance and economic analysis. The presented study is an attempt to compile most of these efforts in order to guide future work to get cheaper low cost investment. From our study the interesting configuration to the next development is D configuration with methanol yield 112 ton/day and capital cost with 526.4 10{sup 6} IDR. The configuration of D with non-discounted and discounted rate had the break-even point approximately six and eight years.

09 BIOMASS FUELS↗

HTTR-GT/H2 test plant - system design - 18680

Pre-licensing basic design for a cogenerating HTGR test plant system is presented. The plant to be coupled to JAEA s existing 30 MWt 950 deg. C test reactor HTTR is intended as a system technology demonstrator for JAEA s commercial Gas turbine High Temperature Reactor Cogeneration (GTHTR300C) plant design. More specifically the test plant of HTTR-GT/H2 aims to 1) demonstrate the licensability of the GTHTR300C for electricity production by gas turbine and hydrogen cogeneration by thermochemical process and 2) confirm the operation control and safety of such cogeneration system. With construction and operation completion by 2025, the test plant is expected to be the first of a kind HTGR-powered cogeneration plant operating on the two advanced energy conversion systems of closed cycle helium gas turbine for power generation and thermochemical iodine-sulfur water-splitting process for hydrogen production. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

PHOTOCHEMICAL HEATING OF DENSE MOLECULAR GAS

Photochemical heating is analyzed with an emphasis on the heating generated by chemical reactions initiated by the products of photodissociation and photoionization. The immediate products are slowed down by collisions with the ambient gas and then heat the gas. In addition to this direct process, heating is also produced by the subsequent chemical reactions initiated by these products. Some of this chemical heating comes from the kinetic energy of the reaction products and the rest from collisional de-excitation of the product atoms and molecules. In considering dense gas dominated by molecular hydrogen, we find that the chemical heating is sometimes as large, if not much larger than, the direct heating. In very dense gas, the total photochemical heating approaches 10 eV per photodissociation (or photoionization), competitive with other ways of heating molecular gas.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗