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Improving Coal Power Economics: Retrofitting Flameless Pressurized Oxy-Combustion with Integral CO2 Capture

Presentation discussing Flameless Pressurized Oxy-combustion (FPO) technology's: philosophy and performance vs. traditional combustion, added value, and development path. Also overviewed is the large pilot planning with an update on DOE Project DE-FE0031580, cycle diagram, and plan for commercial-scale cycle. A summary of the projected cost of electricity for FPO with carbon capture, comparing to pulverized coal technology. New-build and retrofit FPO with PRB coal is compared. FPO new-build retrofit potential outlook for commercialization is addressed.

Reineck, Peter↗

Hybrid Encapsulated Ionic Liquids for Post-Combustion Carbon Dioxide (CO 2 ) Capture

It is increasingly clear that carbon dioxide (CO 2 ) capture and sequestration (CCS) must play a critical role in curbing worldwide CO 2 emissions to the atmosphere. Previously, we have developed ionic liquids (ILs) and phase change ionic liquids (PCILs) for post-combustion CO 2 capture. In this project, we synthesized and tested 19 ILs and PCILs and chose one of each for further development. The IL selected for further development was triethyl(octyl)phosphonium 2-cyanopyrrolide ([P 2228 ][2CNPyr]), which has the same anion but a different cation, than used in our previous work. The new cation imparts a lower viscosity than the prior cation. The PCIL selected for further development was tetraethylphosphonium benzimidazolide ([P 2222 ][BnIm]), which was developed in an Advanced Research Projects Agency-Energy (ARPA-E) project. Although we made numerous other candidates, none were better than this original PCIL. Here we showed that the CO 2 absorption by the IL and the PCIL was completely reversible, even when water was present. We determined and quantified the additional chemistry, involving the formation of bicarbonate, when water is present. The IL and PCIL were encapsulated in silicone shells using a microfluidic device. Compatibility between the IL/PCIL and the polymer, viscosity, and surface tension issues, getting sufficiently high IL/PCIL loading and leakage (likely from insufficient cross-linking), were serious challenges. Small quantities (~ 1 g) of microcapsules with good integrity of both the IL and the PCIL were produced. The CO 2 uptake by these capsules was the same as for the free IL and PCIL and the capacity of the capsules decreased only slightly even after five absorption and desorption cycles. As expected, the IL and PCIL (and subsequently the encapsulated IL and PCIL) reacted readily with SO 2 and NO, so, like aqueous amine absorbents, the CO 2 capture unit would have to be located downstream of the flue gas desulfurization and other gas treatment units. Large samples (~70 g and 100 g) of encapsulated PCIL were produced in a parallel microfluidic device and in an in-air device. These capsules were tested in a Laboratory Scale Unit (LSU) to demonstrate uptake capacity in a fluidized bed. We also used the LSU to determine recyclability and mass transfer coefficients. Unfortunately, equivalent experiments with the IL were not possible due to difficulties with producing large samples of the encapsulated IL. This IL encapsulation “scale-up” problem was not solved during the course of this project. Nonetheless, using the PCIL microcapsules we demonstrated that, as expected, the mass transfer is internally controlled. In concert with a new rate-based model of the fluidized bed, we determined that the productivity is increased by a factor of 4.75 in the microcapsule fluidized bed absorber compared to a conventional liquid-gas packed bed absorber. The initial technoeconomic model shows that the capital cost for the microcapsule IL continuous fluidized bed process is similar to that of an aqueous amine process (specifically, the Econamine FG Plus technology). However, the stripping heat requirements are about 35% less for the model IL microcapsule case compared to the monoethanolamine (MEA) case. Thus, encapsulated ILs/PCILs in a continuous fluidized bed absorber for post-combustion CO 2 capture are a significant improvement over the free IL/PCIL case and represent a major reduction in the parasitic energy requirements compared to aqueous amine process.

20 FOSSIL-FUELED POWER PLANTS↗

Advanced Combustion Numerics and Modeling: FY19 Third Quarter Report

This project is focused on early stage research and development of numerical methods and models to improve advanced engine combustion concepts and systems. The current focus is on the development of new mathematics and algorithms to reduce the time to solution for advanced combustion engine design using detailed fuel chemistry. The research is prioritized towards the most time-consuming workflow bottlenecks (computer and human) and accuracy gaps that slow ACS program members. Zero-RK, the fast and accurate chemical kinetics solver software developed in this project, is central to the research efforts and continues to be developed to address the current and emerging needs of engine designers, engine modelers and fuel mechanism developers.

02 PETROLEUM↗

Coal-fueled Pressurized Chemical Looping Combustion with a Spouting Fluidized Bed

The goal of this final project report is to comprehensively summarize the work conducted on project DE-FE0025098. In accordance with the Statement of Project Objectives (SOPO), the University of Kentucky Center for Applied Energy Research (UKy-CAER) (Recipient) has developed a coal-based combined cycle integrated with a pressurized chemical looping combustion (PCLC) technology to achieve high plant efficiency while capturing CO 2 at low cost. The project involved the design, fabrication, commissioning, parametric testing, and performance validation of the spouted bed approach as coal feeding to narrow the major near-term technical gaps that impede the application of PCLC into solid fuel and scale-up. Specifically, UKy-CAER provided detailed front-end design of a 50 kWth PCLC facility, produced approximately 500 lbs of oxygen carrier (OC) from industrial by-product, Red Mud in addition to commercially available ilmenite, and completed a 70+ hour-long experimental campaign to evaluate the coal feed system and performance and flexibility of the 50 kWth facility with various coal, operating pressures, fluidization agent, and OCs. Project results verified UKy-CAER’s proposed approach to address the major technical gaps of solid-fueled PCLC technology which includes: (1) cost-effective materials for OCs with high reactivity, cyclic capacity, chemical stability, and high resistance to agglomeration with coal ash; (2) fast reaction rates during solid-solid chemical looping combustion (CLC) for reduction of the OC inventory and reactor size; (3) simple and effective ash separation from binary mixtures of the OCs and solid fuel ash; (4) spouting bed coal feeding to suppress OC agglomeration in the reducer resulting from the initial coal devolatilization step, coal tar formation; and (5) pollutant removal to avoid sulfur accumulation in the system or their emission into the hot spent air stream which could result in a second train for SOx removal and potentially cause failure of the flue gas turbine blade. UKy-CAER’s economical cycling material and novel spouted bed reducer configuration shows promise, as summarized in this report, as an effective means for improved plant efficiency with reduced process complexity.

01 COAL, LIGNITE, AND PEAT↗

Distribution combustion

Combustion of natural gas for energy generation during distribution (not including combustion for compressor drivers). To access the model referenced in the report, please visit https://www.netl.doe.gov/energy-analysis/details?id=D1B6537E-87E5-4D85-9117-186A3846D366

03 NATURAL GAS↗

Rotating Detonation Combustion for Gas Turbines: Modeling and System Synthesis to Exceed 65% Efficiency Goal (Phase II)

As of May 2019, all RDE test hardware and test operations were completed for this program. Over 700 hot fire tests were conducted at 4 facilities with 7 RDE assemblies, with the data available for future analysis. In particular, measured static and dynamic pressure and computational fluid dynamics (CFD) provided basis for pressure gain combustion (PGC) analysis of the Engineering Scale RDE. It was demonstrated via measurements and CFD that a carefully designed diffuser can recover some total pressure of the highly oscillatory RDE exhaust. In general, the isolator/injector is largest contributor of pressure losses; however a low loss design was demonstrated that improves significantly on previous natural-gas/air RDEs. Also, a tailored injector and mixing technique was demonstrated that allowed NG-air RDE operation with overall equivalence ratio of less than 0.6. CFD models by AR, the UofM and Purdue University were extensively used throughout the program to refine diffuser design for improved pressure recovery, to simulate injection and mixing, to estimate turbine interaction, to estimate combustor pressure gain anchored with test data and to provide input to other design and analytical tasks. CFD analyses were completed for many of the configurations tested at Purdue with the 13.4” RDE including the shark fin and low area ratio isolators. Results were compared favorably to available hot fire test particle image velocimetry (PIV) measurements and wave speeds. The results of these CFD analyses suggest a modest pressure gain of 33% with a sufficiently low area ratio isolator. A thermodynamic power plant system model was set up which utilizes an RDE combustor. The performance of the RDE combustor module was scaled based on measurements from the Engineering Scale RDE tests with low loss injector and tailored fuel flow. This combined model indicates potential for significant plant efficiency improvement. The successful tailored fuel injection test result with lower than .6 equivalence ratio has implication that a power plant can use a RDE combustor configuration where all the air flows through the combustion zone thereby not requiring a bypass mixer. In this configuration, the results of the natural gas combined cycle (NGCC) plant system indicate net efficiency of 66.4%.

02 PETROLEUM↗

W.A. Parish Post-Combustion CO 2 Capture and Sequestration Demonstration Project (Final Technical Report)

The Petra Nova Project (Project) is a commercial scale post-combustion carbon capture project developed by a joint venture between NRG Energy, Inc. (NRG) and JX Nippon Oil Exploration (EOR) Limited (JX). The Project is designed to separate and capture carbon dioxide (CO2) from an existing coal-fired unit’s flue gas slipstream at NRG’s W.A. Parish Electric Generating Station (WAP) located southwest of Houston, Texas. The captured CO2 is dried, compressed, and transported via an 81-mile pipeline to the West Ranch oilfield (West Ranch) in Jackson County, Texas, where it is injected to boost oil production. The Project, which is partially funded by a grant (Grant) from the United States (U.S.) Department of Energy (DOE) under the Clean Coal Power Initiative (CCPI) Round 3, uses the Kansai Mitsubishi Carbon Dioxide Recovery advanced amine-based CO 2 absorption technology (KM-CDR Process®), which was jointly developed by Mitsubishi Heavy Industries, Ltd. (MHI) and the Kansai Electric Power Co. Inc., to treat and capture at least ninety percent (90%) of the CO 2 from a 240-megawatt equivalent (MWe) flue gas slipstream off of Unit 8 at WAP. When operating at full capacity, the Project captures approximately 5,200 short tons of CO 2 per day, which would otherwise be emitted into the atmosphere, representing the largest commercial scale deployment of post-combustion CO2 capture technology at a coal power plant to date. Under the Grant, the Project was managed in 3 phases: (1) Phase 1: Project Definition / Front End Engineering Design (FEED) (2) Phase 2: Detailed Engineering, Procurement & Construction (3) Phase 3: Demonstration and Monitoring. On December 29, 2016, commercial operation of the Project was achieved, ending Phase 2 and starting Phase 3, a 3-year demonstration period running from January 1, 2017 through December 31, 2019. The key objectives of Phase 3 were to (a) demonstrate the specific advanced technologies constructed during Phase 2 and (b) monitor the injected CO 2 at West Ranch to demonstrate technologies and protocols for monitoring, verification, and accounting (MVA). As of the end of Phase 3, Petra Nova captured 3,904,978 short tons of CO 2 (3,542,537 metric tons) that was transported to West Ranch. To support the DOE obligation to monitor, verify, and account for the sequestered CO 2 at West Ranch, Petra Nova contracted with the Bureau of Economic Geology (in the Jackson School of Geosciences at The University of Texas at Austin) to (a) design a monitoring program, (b) draft an MVA Plan for DOE review and approval, and (c) working with Petra Nova and the operator of West Ranch to manage and report on the MVA activity. This report discussed the technical aspects of the project during each of the 3 phases of the project as identified above.

01 COAL, LIGNITE, AND PEAT↗

Biomass Combustion in a Circulating Fluidized Bed Combustor

Interest in circulating fluidized bed (CFB) boilers as a power generation technology has skyrocketed in recent years because of several advantages this technology offers over conventional boilers, such as increased gas-solid mixing resulting in higher combustion efficiency and the ability to use lower quality fuels. CFB combustors are operated at lower temperatures than conventional thermal power generation combustors, thus reducing NO x emissions. SO 2 emissions are conveniently controlled through the addition of Ca-based sulphur sorbents within the combustor. This report summarizes the current modeling effort on a 50 kW th CFB combustor with a diameter of 10 cm and a height of 5 m; designed, built, and operated at CanmetENERGY in Ottawa, Canada employing the multiphase particle-in-cell (PIC) approach in the open-source Multiphase Flow with Interphase eXchanges (MFiX) Software Suite. The MFiX-PIC model parameters for the simulation are tuned against cold-flow experiments from CanmetENERGY using 9 kg of olivine sand as the inert bed material. It is shown that for the relatively coarse fluid meshes and large parcel sizes necessitated by the scale of the simulation, filter size dependent corrections to the drag law must be incorporated to ensure accuracy of the simulation results. The validated cold flow model is extended to simulate reacting flow with torrefied hardwood as the feedstock and to validate the combustion reaction scheme. The species concentrations at the riser outlet are compared against CanmetENERGY’s experiments and show satisfactory agreement. The simulations demonstrate the ability of MFiX-PIC to accurately capture the physics and chemistry of a circulating fluidized bed combustor at bench scales, which can be further extended to pilot- and industrial-scale systems.

20 FOSSIL-FUELED POWER PLANTS↗

Advanced Light-Duty Spark Ignition Engine Research: Co-Optimization of Fuels and Engines and Partnership to Advance Combustion Engines (FY2020 Annual Progress Report)

This report covers recent progress on research tasks that support both the Co-Optimization of Fuels and Engines (Co-Optima) initiative and the Partnership to Advance Combustion Engines (PACE) consortium. The Co-Optima tasks further the science-base needed by industry stakeholders to co-evolve the next generation of highly efficient direct injection spark ignition (DISI) engines and new gasoline-type fuels. The research emphasis is on fuel effects on multimode spark ignition (SI) engine operation, which uses traditional non-dilute stoichiometric operation for peak load and power but reverts to lean operation at lower loads to provide higher fuel economy. This work focuses on determining desirable fuel specifications in terms of well-established metrics like research octane number (RON) and motor octane number, but it also involves the assessment of new fuel metrics, including fuel sooting propensity and phi-sensitivity. The PACE task supports the development of predictive computational fluid dynamics (CFD) modeling, which promises to unlock new strategies for high-efficiency combustion while minimizing tailpipe emissions. Here, the primary fuel is a regular E10 gasoline (i.e., a regular gasoline blend containing 10% ethanol), and focus is on fuel-spray dynamics and soot emissions. Soot-formation pathways are studied to determine how the pathways change with injection strategies and the thermal state of the engine (i.e., cold-starting vs. fully warmed-up operation). This PACE task also contributed to the development of an optimal E10 gasoline surrogate fuel, as reported in detail elsewhere

33 ADVANCED PROPULSION SYSTEMS↗

Plasma Ignition and Combustion Stabilization Technology to Improve Flexible Operation, Reliability and Economics of an Existing Coal-Fired Boiler

GE Steam Power, Inc. (GE) proposed to improve reliability, flexibility, and economics of an existing coal-fired power plant by applying a new advanced technology developed by GE, a plasma-assisted pulverized fuel firing system. The objective of this program is to demonstrate the achievement of lower load by improved flame stabilization and therefore lower operating costs in a full-scale field installation at coal-fired electric utility. GE’s Plasma Ignition and Combustion Stabilization System is designed to operate continuously to support low load operation. With the plasma on, the flame will be attached and stable, removing the firing system as a limitation to low load operation. In addition, GE’s exclusively from ABENZ company licensed AC based technology has a 90+% system efficiency compared to all other systems at which are DC and operate with ~75% efficiency. Plant operating costs are lowered by eliminating use of expensive support fuel as well as the ability to operate at lower loads. The utilities’ ability to better match the demand curve will result in significant savings. Maintenance is lower for an AC system than a DC system as it operates at lower current. This eliminates the need for a demineralized cooling water system and provides longer electrode life which translates into both material and labor savings. It is the objective of GE to not only demonstrate the additional low load achievable with a plasma system after best achievable tuning, sensor and software approach has been exhausted, but also the increased stability of the flame at all loads with plasma assistance as well as cost savings at all low loads using plasma instead of oil. Upon successful completion of this project, GE will have sufficient field experience to rapidly deploy the Plasma Technology. The project objectives were achieved through the implementation of plasma ignitor technology at PacifiCorp Hunter Station Unit 3. A plasma ignitor system was retrofitted on ten wall-fired burners, Mill 3-4 combustion system. The Plasma Ignitors installed at Hunter proved that this GE technology is a direct and complete replacement for the original oil ignitors. The Hunter Unit 3 burner management system allows the plasma system to be used in all applications that originally required oil to be burned. This includes any time the Mill 3-4 is started or stopped for any reason including boiler starts, load changes, and low load support.

01 COAL, LIGNITE, AND PEAT↗

Comparative Study for Pressure Gain Combustion-Gas Turbine System Performance in NGCC Configurations

The Department of Energy (DOE) has a goal to increase natural gas combined cycle (NGCC) plant efficiency to greater than 70 percent on a lower heating value (LHV) basis. Improvement in gas turbine (GT) efficiency is key achieving this goal. While many of the traditional improvement methods (higher firing temperature, advanced materials, improved cooling methods, etc.) may increase current GT and NGCC efficiencies incrementally, combining these traditional advancements with breakthrough technologies such as pressure gain combustion (PGC) may provide significant system efficiency gains. PGC is a combustion process that results in a net pressure increase across the combustor (up to pressure ratio of 2.2) rather than the traditional (<5%) pressure drop. There are multiple PGC technologies being developed that create the pressure rise phenomena, including resonant pulse combustors (RPCs), pulse detonation engines (PDEs), wave rotor combustor (WRC) engines and rotating detonation engines (RDEs). In this study, scoping analyses of PGC concepts applied to NGCC power plants were performed by combining simplified analytical models for the RPC, PDE, WRC, and RDE types of pressure gain processes with a GT model to evaluate impacts of using each of the PGC technologies on key GT performance parameters. Sensitivity analyses were also performed. Ultimately, the PGC technologies were found to have the potential to increase simple cycle efficiency by 4–6 percent (absolute) and NGCC efficiency by 2–3 percent (absolute) based on the results of the current study.

03 NATURAL GAS↗

Pilot Testing of a Highly Efficient Pre-combustion Sorbent-based Carbon Capture System

TDA developed and demonstrated a highly efficient pre-combustion carbon capture system. The overall objective of this work was to develop a new sorbent-based pre-combustion carbon capture technology for Integrated Gasification Combined Cycle (IGCC) power plants. In this project our goal was to demonstrate the techno-economic viability of the new technology by 1) demonstrating it in large-scale slipstream tests, and 2) carrying out a high fidelity engineering and cost analysis. TDA’s process used an advanced physical adsorbent that selectively removes CO 2 from coal-derived synthesis gas above the dew point of the gas at temperatures as high as 300°C. The sorbent consists of a mesoporous carbon whose surface was grafted with functional groups that remove CO 2 via a well-known acid-base interaction. As documented in bench-scale experiments and field tests with actual coal gas, the sorbent achieved a very high capacity for CO 2 at temperatures as high as 300°C. The sorbent bound CO 2 more strongly than common physical adsorbents, providing the chemical potential needed for the high temperature operation. However, because CO 2 does not form a true covalent bond with the surface sites (as is the case with chemical absorbents), the sorbent regeneration could be carried out with only a very small energy input. The heat input to regenerate our sorbent was only 4.9 kcal per mol of CO 2 , which is much lower than that for chemical absorbents (e.g., 29.9 kcal/mol CO 2 for sodium carbonate) and was similar to the requirements of physical solvents (e.g., 4 kcal/mol CO 2 for Selexol TM ). Because the sorbent operates above the dew point of the synthesis gas (unlike the Selexol TM process), a higher power cycle efficiency can be achieved. With previous DOE/NETL funding (Contract No. DE-FE-0000469), we demonstrated the techno-economic viability of the technology in bench-scale tests and slipstream demonstrations at the National Carbon Capture Center (NCCC), Wilsonville, Alabama and Wabash River IGCC plant in Terra Haute, Indiana. We demonstrated a stable working CO 2 capacity for over 11,650 cycles with simulated synthesis gas. We also evaluated its performance with actual synthesis gas in two test campaigns at the Wabash River IGCC Plant, Terre Haute, IN and the National Carbon Capture Center (NCCC), Wilsonville, AL. The slipstream tests clearly showed that the actual coal gas constituents and potential contaminants (e.g. trace metals, halides, tars) had no effect on the sorbent’s ability to remove CO 2 (the same sorbent beds were used in both field tests with no sign of deactivation for 2,000 cycles with over 26,750 SCF of gas treated). As expected, due to the high temperature CO 2 removal capability and low energy needed to regenerate the sorbent, the power cycle efficiency with our process was greater than 34% on a higher heating value (HHV) basis; in comparison, the same IGCC plant equipped with the Selexol TM solvent for carbon capture can only achieve 31.4% HHV efficiency. The capital cost for an IGCC system with TDA’s process is estimated as $2,417/kW e , which is 12% lower than that of the IGCC/ Selexol TM process. The levelized cost for electricity including the transport, storage and monitoring (TS&M) cost for CO 2 was calculated as $\$ $92.9/MWh (lowest reported to our knowledge), which is much better than the $105.2/MWh estimated for the IGCC/ Selexol TM process. In this project (DE-FE0013105), TDA Research, in collaboration with our partners Gas Technology Institute (GTI), Illinois Clean Coal Institute (ICCI), University of California, Irvine (UCI), University of Alberta (UOA), Siemens, NCCC and Sinopec advanced the technical maturity of the technology; scaling it up by a factor of 100. We optimized the reactor design using computational fluid dynamics (CFD); using adsorption modeling we improved the pressure swing adsorption (PSA) cycle sequence. We carried out two field test campaigns with a fully-equipped 0.1 MW e prototype unit (for a total of 844 hours) using actual synthesis gas to prove the viability of the new technology. A successful 30 day (707 hrs) evaluation was completed at NCCC under air blown gasification conditions. We demonstrated 97.3% carbon capture at 1,500 SLPM, 93% carbon capture at 1,800 SLPM, and 90% carbon capture at 2,100 SLPM in the NCCC tests. We also demonstrated the system for 137 hours at a Sinopec petrochemical plant under oxygen blown gasification, demonstrating 86% carbon capture at 2,660 SLPM. In collaboration with University of California, Irvine (UCI), we completed a techno-economic analysis (TEA) for TDA’s warm gas cleanup technology integrated to IGCC power plant. The net plant efficiencies (on a coal HHV basis) for the warm gas cleanup cases were estimated to be 34.0% for E-GasTM gasifier, 34.4% for GE gasifier, 33.4 for the Shell gasifier and 34.2 for the TRIG TM gasifier (Cases 2, 4, 6 and 8 in this study) with a catalytic combustor for CO 2 purification, which are significantly higher than those for the Cold Gas Case, or an increase of as much as 12% in the heat rate for Case 2, 6% for Case 4, 9% for Case 6, and 9% for Case 8. The 1st year cost of electricity with the transport, storage and monitoring (TS&M) costs for the CO 2 included was $\$ $129.2/MWh for the E-GasTM gasifier Warm Gas Cleanup Case, $\$ $131.9/MWh for the GE gasifier Warm Gas Cleanup Case, $\$ $146.8/MWh for the Shell Gasifier Warm Gas Cleanup Case, and $\$ $129.9/MWh for the TRIG TM gasifier Warm Gas Cleanup Case. For comparison, the costs for the baseline Cold Gas CO 2 removal with Selexol for the different gasifiers were: $\$ $146.6/MWh for the E-Gas TM gasifier, $\$ $142.2/MWh for the GE gasifier, $\$ $159.0/MWh for the Shell gasifier and $\$ $144.3/MWh for the TRIG TM gasifier. In summary, the costs for our system were 7 to 12% lower than the corresponding Cold Gas Cleanup cases. The results of this techno-economic analysis suggested that TDA’s high temperature PSA-based Warm Gas Clean-up Technology can make a substantial improvement in the IGCC plant thermal performance for achieving near zero CO 2 emissions for E-Gas TM , GE, Shell and TRIG TM gasifier based IGCC power plants. The capital expenses were estimated to be lower than that of Selexol’s™. Taken together, the higher net plant efficiency and lower capital and operating costs resulted in substantial reduction in the cost of carbon capture for the IGCC plant equipped with TDA’s high temperature PSA-based carbon capture system. Finally, in collaboration with Gas Technology Institute (GTI) we completed the environmental health and safety assessment for TDA’s warm gas carbon capture technology.

01 COAL, LIGNITE, AND PEAT↗

Combustion of Butyl acetate as an alternative additive to petroleum fuels

Blending petroleum fuels with oxygenates is a common approach to stem the depletion of crude oil while also mitigating the impact of their combustion on the environment. It has recently been considered that butyl acetate (BA, C6H12O2 , boiling point of 399K) could be a viable oxygenate additive to diesel fuel. The platform used to study combustion of commercial and synthesized BA was an isolated droplet burning with spherical symmetry. The experiments were carried out in a drop tower to minimize buoyant convection. Restricting motion by supporting droplets on 14 micrometer fibers eliminated forced convection. Precise control of the initial diameter was achieved by first deploying large droplets and letting them evaporate to the size of interest, here being between 0.3 mm to 0.8 mm. The experimental results show that commercial and the newly synthesized BA burned almost identically for the evolution of droplet and flame diameters. Droplets burned slower as the initial diameter was increased and soot formation was noted for the larger sizes studied due to a residence size effect. Burning in a buoyant convective field showed higher burn rates due to the convective effect and that the asymmetric flames became nearly spherical as diameter decreased. The study illustrates the significant value that the microgravity environment brings to evaluating performance of oxygenated fuels synthesized by new production methods.

Wang, Yujie↗

Flexible Oxy-Fuel Combustion for High-Penetration Variable Renewables

A thermodynamic model was developed for the oxy-combustion Allam-Fetvedt cycle. This information was then used to develop an optimized dispatch strategy using price strips supplied by the modeling teams. The price strips represent future possible grid configurations that include a high penetration of variable renewables and a carbon tax. Multiple optimization strategies and tools were used to maximize the net present value (NPV) of the plant on these potential future grids. The optimization varied the size of the air separation unit, the size of oxygen storage tanks, the size of carbon dioxide storage tanks and the flow rate of the carbon dioxide pipeline. The team was able to determine a dispatch strategy that resulted in a positive NPV for all price strips. This indicates that an oxy-combustion plant with oxygen storage would be economically viable on a future grid with a high degree of variable renewables.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Modeling and Optimization of Zeolites for Contaminant Removal from Coal Combustion Impoundment Leachates

Coal Combustion Residual (CCR) landfills in the U.S. can lead to elevated contaminant concentrations in groundwater and runoff, particularly of arsenic, boron, and selenium. Zeolites can be readily synthesized from materials contained within the coal combustion ash impoundments and can be cation-exchanged to enhance adsorption capacity, selectivity, and reactivity. However, the optimization of zeolites becomes a daunting task when accounting for the variety of Si:Al ratios, the species of extra-framework cations present, and the zeolite pore structure. Molecular simulations provide methods to study and guide the design of zeolites for the sorption of contaminants from aqueous solution. In this work, models that predict the sorption of arsenic, boron, and selenium from water using cation-exchanged zeolites. Because of the lack of experimental adsorption data for these species of contaminants, models were parametrized to reproduce the results of first-principles calculations and then used to predict sorption for zeolites for a dataset containing 6000 combinations of zeolites and sorption conditions. Machine learning was used to train a model to predict sorption for materials in this database based on the results of the molecular simulations. Next, a genetic algorithm was used to optimize zeolites for the removal of each contaminant from aqueous solution for individual impoundment sites based on contaminant concentrations reported by the Electric Power Research Institute.

Findley, John↗

Sustainable Aviation Fuel Combustion, Soot, and Contrail Formation

The aviation industry stands at a crossroads, facing the dual challenge of meeting the growing global demand for air travel while mitigating its environmental impact. As concerns over climate change intensify, sustainable aviation fuels (SAFs) have emerged as a promising solution to reduce the carbon footprint of air travel. The aviation sector has long been recognized as a contributor to greenhouse gas emissions, with carbon dioxide (CO 2 ) being a primary concern. SAFs, derived from renewable feedstocks such as biomass, waste oils, or synthetic processes, offer a promising avenue for reducing the net carbon emissions associated with aviation. While SAFs have shown potential in lowering CO 2 emissions, the combustion process introduces complexities related to soot particle formation and contrail generation that require comprehensive exploration. These aspects are pivotal not only for their environmental implications but also for their influence on atmospheric climate interactions. As the aviation industry increasingly embraces SAFs to meet sustainability goals, it is imperative to assess their combustion characteristics, unravel the mechanisms of soot formation, and scrutinize the factors influencing contrail development.

09 BIOMASS FUELS↗