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Active Reservoir Management Engineering and Evaluation Summary – Brine Extraction and Storage Test Phase II Final Report – Volumes 1-3

The Energy & Environmental Research Center (EERC) conducted a multiyear program over two phases to perform a field study of the potential efficacy of formation water extraction during carbon dioxide (CO 2 ) injection for CO 2 storage as a means of improving efficiency and/or effectiveness. Phase I was a 2-year study on potential methodologies for a field study of pressure management, culminating in site selection and experimental and site design. Phase II was a 7-year effort that involved constructing site facilities, conducting experiments, and evaluating collected field data. The experimental portion was split into two collaborative components, one for the active reservoir management (ARM) experiment and a second component to host and demonstrate potential water treatment technologies appropriate for high-saline brine at the project site. The results of the overall project are expected to benefit future saline storage projects through validation of techniques that may reduce stress on sealing formations, increase storage capacity, and reduce area of review. The following report focuses on the Phase II ARM experimental implementation and results. A second companion report summarizes the results of the high-saline brine demonstrations.

54 ENVIRONMENTAL SCIENCES↗

CLEERS Aftertreatment Modeling and Analysis

DOE FY 2011 Advanced Combustion Technologies Annual Report. CLEERS is a research and development focus project of the Diesel Cross-Cut Team. The overall objective is to promote the development of improved computational tools for simulating realistic full-system performance of lean-burn engines and the associated emissions control systems. Three fundamental research projects are sponsored at PNNL through CLEERS: DPF, SCR, and LNT. Resources are shared between the three efforts in order to actively respond to current industrial needs. In FY 2011, more emphasis was placed on the SCR and LNT activities because of urgent application issues associated with these technologies. Objectives of this project are to lead and contribute to the Cross-Cut Lean Exhaust Emissions Reduction Simulations (CLEERS) activities - (a) Provide project updates to the industry sub-team, solicit feedback, and adjust work scope accordingly; and (b) Lead technical discussions, invite distinguished speakers, and maintain an open dialogue on selective catalytic reduction (SCR), lean-NOx trap (LNT), and diesel particulate filter (DPF) modeling issues. Fiscal Year (FY) 2011 Objectives are to: (1) Develop improved modeling capabilities for SCR and DPFs through fundamental experiments; and (2) Develop a fundamental understanding of SCR and LNT catalysts with primary focus on reaction mechanisms and material characterization. Some accomplishments are: (1) Participated in monthly CLEERS teleconferences and coordinated the calls focused on SCR, LNT and DPF technologies; (2) Updated PNNL's SCR model for the state-of-the-art commercial Cu-zeolite SCR catalyst to extract kinetic parameters and to quantitatively describe the effects of hydrothermal aging; (3) Examined the effects of hydrothermal aging on the physicochemical properties and SCR reactions using the commercial Cu catalyst in collaboration with Oak Ridge National Laboratory (ORNL); (4) Investigated the nature of Cu species and obtained kinetic parameters for small-pore zeolite-based Cu SCR catalyst. (5) Examined the effects of support materials for Ba-based LNT catalysts, and found magnesium aluminate may improve the oxides of nitrogen (NO{sub x}) reduction performance at high temperatures; (6) Investigated soot oxidation mechanisms for relevant oxidants (O{sub 2}, NO{sub 2}) through reactor experiments and transmission electron spectroscopy (TEM) analysis; (7) Seven publications and 21 public presentations (eight invited) during the past FY; and (8) Co-organized sessions on emission control and modeling for the SAE World Congress and the American Society of Mechanical Engineers Internal Combustion Engine Conference.

33 ADVANCED PROPULSION SYSTEMS↗

Naval Station Newport Wind Resource Assessment

The U.S. Environmental Protection Agency (EPA) launched the RE-Powering America's Land initiative to encourage development of renewable energy (RE) on potentially contaminated land and mine sites. EPA is collaborating with the U.S. Department of Energy's (DOE's) National Renewable Energy Laboratory (NREL) to evaluate RE options at Naval Station (NAVSTA) Newport in Newport, Rhode Island where multiple contaminated areas pose a threat to human health and the environment. Designated a superfund site on the National Priorities List in 1989, the base is committed to working toward reducing the its dependency on fossil fuels, decreasing its carbon footprint, and implementing RE projects where feasible. The Naval Facilities Engineering Service Center (NFESC) partnered with NREL in February 2009 to investigate the potential for wind energy generation at a number of Naval and Marine bases on the East Coast. NAVSTA Newport was one of several bases chosen for a detailed, site-specific wind resource investigation. NAVSTA Newport, in conjunction with NREL and NFESC, has been actively engaged in assessing the wind resource through several ongoing efforts. This report focuses on the wind resource assessment, the estimated energy production of wind turbines, and a survey of potential wind turbine options based upon the site-specific wind resource.

14 SOLAR ENERGY↗

Building and Executing Aggressive Research Plans in a Large National Laboratory Consortium: Insights from the Co-Optimization of Fuels and Engines Initiative

This report describes lessons learned in the establishment, execution and termination of a large, multi-institutional consortium, derived from the Co-Optimization of Fuels and Engines experience. The decision to form a consortium comes with benefits (in advancing challenging multidisciplinary research) and costs (in time and additional management funds). Once the decision is made, key elements to a strong start include establishing a shared vision and goals; engaging an experienced project manager early; instituting feedback and oversight mechanisms to ensure relevance, strong performance, and situational awareness. Once a consortium is up and running, DOE and leadership should strike the right balance between competition and collaboration; foster an environment that builds trust; and adjust the organizational structure as needed to maintain collaboration. Finally, DOE and the labs can plan effectively for a smooth transition as a consortium winds down. This report provides some additional lessons and details on these lessons that we hope future DOE and lab leaders will find useful as they contemplate standing up new consortia.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Energy Assessments under the Top 10,000 Program - A Case Study for a Steel Mill in China

One of the largest energy-savings programs for the Chinese industrial sector was the Top-1,000 Program, which targeted the 1,000 largest industrial enterprises in China. This program was launched in 2006, implemented through 2010, and covered 33% of national energy usage. Because of the success of the Top-1000 initiative, the program has now been expanded to the Top-10,000 program in the 12th Five-Year Plan period (2011-2015). The Top-10,000 program covers roughly 15,000 industrial enterprises, or about two-thirds of China s total energy consumption. Implementing energy audit systems and conducting industrial energy efficiency assessments are key requirements of the Top-10,000 program. Previous research done by Lawrence Berkeley National Laboratory (LBNL) has shown that there is a significant potential for improvement in energy assessment practices and applications in China. Issues such as lack of long term policy mechanisms, insufficient motivation for industrial enterprises, limited technical scope of energy assessments, and lack of systematic standardization have been identified. Through the support of the U.S. Department of Energy (DOE) and the U.S. State Department (with additional co-funding from the Energy Foundation China), LBNL, Oak Ridge National Laboratory, the Institute for Sustainable Communities (ISC), and DOE Energy Experts worked collaboratively with Chinese local organizations and conducted a series of industrial energy efficiency assessment demonstrations in selected Chinese industrial plants. The project aimed to not only introduce standardized methodologies and tools for energy assessments, but also to bring the systems approach for energy system analysis to the Top 10,000 enterprises. Through the project, five energy system assessments were conducted, and more than 300 Chinese experts from local energy conservation centers, universities, research organizations, energy service companies, and plant engineers were trained. This paper begins by introducing China s national energy intensity and carbon intensity reduction targets. Then, this paper explains the development of Top 10,000 program, including program requirements, the method for target allocation, key supporting policies, as well as challenges in implementing the program. By focusing on a process heating energy system assessment conducted in a Chinese steel mill, this paper presents an example of an energy system assessment conducted on steel reheating furnaces, including overall energy efficiency levels, areas of heat loss, and the potential for energy savings. In addition, the paper provides energy-savings recommendations that were identified during the assessment, as well as potential energy and energy costs savings. To conclude, this paper presents key findings that could further improve the Top 10,000 program by implementing a systems approach for energy assessments.

China Energy Efficiency↗

UK-US Collaboration on Fossil Energy R&D: Steam Side Oxidation

In recent years, interest in increasing the efficiency of power plants based on steam generation has led to the need to develop and qualify materials capable of operating at steam temperatures and pressures significantly higher than those employed in current power plants. The overall focus of this international program is on using ferritic-martensitic steels to the maximum possible temperature, before switching to austenitic steels and/or Ni-based alloys. The relatively low Cr content of these alloys raises concerns regarding their resistance to steam oxidation at these higher temperatures. Earlier work in this collaboration addressed the reliability of data from atmospheric pressure, laboratory-based steam oxidation tests. This raised issues regarding how representative the laboratory-grown oxides were compared to those formed on service-exposed material and how the tests could be made more reliable by introducing added complexity. In general laboratory-scale exposures are conducted under isothermal conditions at ambient or slightly elevated pressure, using a relatively low flow rate of steam. The coupons used in these tests are normally flat cuboids which have been ground to homogenise the surface and remove any pre-existing features. However, there is a concern that these samples and exposures are not representative of service conditions, and so it is necessary to quantify the influence of transient conditions, such as heat flux, pressure and sample geometry/surface conditions. To address such concerns a new collaborative program of work was initiated to determine the influence of these added features on oxidation kinetics and oxide scale morphology. The overall aim was to improve the understanding of alloy performance in ultrasupercritical (USC) steam conditions and qualify suitable test procedures.

20 FOSSIL-FUELED POWER PLANTS↗

Biofouling Analysis for Wave Energy Piston Design: CRADA 542 [Abstract only]

Triton System’s Wave Energy Converter (WEC) uses an oscillating water column approach to provide small scale power to ocean observing and navigational buoys. Biofouling and corrosion are a major concern for all ocean-deployed components, especially when mechanical motion is involved. Triton Systems will collaborate with PNNL to evaluate seals, materials, and component performance in a controlled biofouling test environment. Results from this testing will be used to improve seal design and material selection, mitigating risk of premature failure during open water testing and evaluation.

16 TIDAL AND WAVE POWER↗

Wireless microwave acoustic sensor system for condition monitoring in power plant environments

This project successfully demonstrated novel wireless microwave acoustic temperature and pressure sensors that can be embedded into equipment and structures located in fossil fuel power plant environments to monitor the condition of components such as steam headers, re-heat lines, water walls, burner tubes, and power turbines. The wireless microwave acoustic sensor technology researched and developed through a collaborative partnership between the University of Maine and Environetix Technologies Corporation can provide a revolutionary impact in the power industry since it is anticipated that the wireless sensors will deliver reliable real-time sensing information in harsh power plant conditions that involve temperatures up to 1100oC and pressures up to 750 psi. The work involved the research and development of novel high temperature harsh environment thin film electrodes, piezoelectric smart microwave acoustic sensing elements, sensor encapsulation materials that were engineered to function over long times up to 1100oC, and a radio-frequency (RF) wireless interrogation electronics unit that are located both inside and outside the high temperature harsh environment. The UMaine / Environetix team have interacted with diverse power plant facilities, and identified as a testbed a local power generation facility, which burns municipal solid waste (MSW), the Penobscot Energy Recovery Company (PERC), Orrington, Maine. In this facility Environetix / UMaine successfully implemented and tested multiple wireless temperature sensor systems within the harsh-environment of the economizer chamber and at the boiler tubes, transferring the developed technology to the power plant environment to perform real-time sensor monitoring experiments under typical operating conditions, as initially targeted in the project. The wireless microwave acoustic sensor technology developed under this project for power plant applications offers several significant advantages including wireless, battery-free, maintenance-free operation, and operation in the harsh-environment of power plant equipment up to about 1100 oC. Their small size and configuration allows flexible sensor placement and embedding of multiple sensor arrays into a variety of components within power systems that can be interrogated by a single RF unit. The outcomes of this project and technological transfer respond to a DOE analysis need, which indicated that if one percent efficiency in coal burning is achieved, an additional 2 gigawatt-hours of energy per year is generated and the resulting coal cost savings is $300 million per year, also accompanied by a reduction of more than 10 million metric tons of CO2 per year emitted into the atmosphere. Therefore, the developed harsh environment wireless microwave acoustic sensor technology and the technological transfer achievements that resulted from the execution of this project have significant impact for power plant equipment and systems and are well-positioned to contribute to the cost reduction in power generation, the increase in power plant efficiency, the improvement in maintenance, the reduction in down-time, and the decrease in environmental pollution. The technology is also in a position to be extended to address other types of high-temperature harsh-environment power plant and energy sector sensing needs.

20 FOSSIL-FUELED POWER PLANTS↗

Roadmap for Testing and Validation of Electric Vehicle Communication Standards

Vehicle to grid communication standards are critical to the charge management and interoperability among plug-in electric vehicles (PEVs), charging stations and utility providers. The Society of Automobile Engineers (SAE), International Organization for Standardization (ISO), International Electrotechnical Commission (IEC) and the ZigBee Alliance are developing requirements for communication messages and protocols. While interoperability standards development has been in progress for more than two years, no definitive guidelines are available for the automobile manufacturers, charging station manufacturers or utility backhaul network systems. At present, there is a wide range of proprietary communication options developed and supported in the industry. Recent work by the Electric Power Research Institute (EPRI), in collaboration with SAE and automobile manufacturers, has identified performance requirements and developed a test plan based on possible communication pathways using power line communication (PLC). Though the communication pathways and power line communication technology options are identified, much work needs to be done in developing application software and testing of communication modules before these can be deployed in production vehicles. This paper presents a roadmap and results from testing power line communication modules developed to meet the requirements of SAE J2847/1 standard.

Pratt, Richard M.↗

Search, engineering, and applications of new oxidative biocatalysts

Abstract Most industrial enzymes are hydrolases, such as glycosidases and esterases. However, oxidoreductases have an unexploited potential for substituting harsh (and scarcely selective) chemical processes. A group of basidiomycetes are the only organisms degrading the aromatic lignin polymer, enabling the subsequent use of plant polysaccharides. Therefore, these fungi and their ligninolytic peroxidases are the biocatalysts of choice for industrial delignification and oxidative biotransformations of aromatic and other organic compounds. The latter also include oxygenation reactions, which are catalyzed with high regio/stereo selectivity by fungal peroxygenases. In search for novel and more robust peroxidases/peroxygenases, basidiomycetes from unexplored habitats were screened, and hundreds of genes identified in basidiomycete genomes (in collaboration with the DOE JGI). The most interesting genes were heterologously expressed, and the corresponding enzymes structurally‐functionally characterized. The information obtained enabled us to improve the enzyme operational and catalytic properties by directed mutagenesis. However, the structural‐functional relationships explaining some desirable properties are not established yet and, therefore, their introduction was addressed by ‘non‐rational’ directed evolution. Then, over 100 oxidative biotransformations were analyzed. Among them, it is noteworthy to mention the regio/stereo selective hydroxylation of long/short‐chain alkanes (a chemically challenging reaction), epoxidation of alkenes, and production of hydroxy‐fatty acids. Concerning aromatic oxygenations, the regioselective hydroxylation of flavonoids, and stereoselective hydroxylation/epoxidation of alkyl/alkenyl‐benzenes were among the most remarkable reactions, together with enzymatic hydroxylation of benzene (as an alternative for harsh chemical process). Finally, peroxidases and peroxygenases also showed a potential as delignification biocatalysts and in the decolorization of contaminant dyes from textile industries. © 2014 The Authors. Biofuels, Bioproducts and Biorefi ning published by Society of Chemical Industry and John Wiley & Sons, Ltd.

Martínez, Angel T.↗

Accurate determination of the electron spin polarization in magnetized iron and nickel foils for Møller polarimetry

The Møller polarimeter in Hall A at Jefferson Lab in Newport News, VA, has provided reliable measurements of electron beam polarization for the past two decades. Past experiments have typically required polarimetry at the 1% level of absolute uncertainty which the Møller polarimeter has delivered. However, the upcoming proposed experimental program including MOLLER and SoLID have stringent requirements on beam polarimetry precision at the level of 0.4% (The MOLLER Collaboration, 2014; The SoLID collaboration, 2019), requiring a systematic re-examination of all the contributing uncertainties. Møller polarimetry uses the double polarized scattering asymmetry of a polarized electron beam on a target with polarized atomic electrons. The target is a ferromagnetic material magnetized to align the spins in a given direction. In Hall A, the target is a pure iron foil aligned perpendicular to the beam and magnetized out of plane parallel or antiparallel to the beam direction. The acceptance of the detector is engineered to collect scattered electrons close to 90° in the center of mass frame where the analyzing power is a maximum (-7/9). One of the leading systematic errors comes from determination of the target foil polarization. Polarization of a magnetically saturated target foil requires knowledge of both the saturation magnetization and g', the electron g-factor which includes components from both spin and orbital angular momentum from which the spin fraction of magnetization is determined. Target foil polarization has been previously addressed in a 1997 publication “A precise target for Møller polarimetry” by de Bever et al. (1997) at a level of precision sufficient for experiments up to this point. Several shortcomings with the previous published value require revisiting the result prior to MOLLER. Here, we utilize the existing world data to provide a best estimate for target polarization for both nickel and iron foils including uncertainties in magnetization, high-field and temperature dependence, and fractional contribution to magnetization from orbital effects. We determine the foil electron spin polarization at 294 K to be 0.08020 ± 0.00018 (@4 T applied field) for iron and 0.018845+/-0.000053 (@2 T applied field) for nickel. Finally, we conclude with a brief discussion of additional systematic uncertainties to Møller polarimetry using this technique.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Fabrication of superconducting Nb 3 Sn film by Co-sputtering

High-efficiency SRF cavities are the key technology to construct cost-effective CW SRF accelerators. Improvements in the efficiency of SRF cavities are realized by using novel materials, such as niobium-tin. Advances in niobium-tin coatings on the inner surface of SRF cavities showed the potential for this material to increase the operating temperature of the SRF cavity to above 4 K, leading to significant reduction of the capital and operating cost of SRF accelerators. Among the techniques used to apply the niobium-tin coating to the surface of the SRF cavity is sputtering. Old Dominion University, Jefferson Lab, and Fermilab are collaborating on developing an optimized niobium-tin coating of the inside surface of niobium SRF cavities using a recently-developed cylindrical sputtering system. This research will result in optimized sputtering coating techniques leading to high efficiency SRF structures.

42 ENGINEERING↗

Joint Appointments: General Principles for Joint Appointments between LANL and University Partners

The Joint Appointment Program provides opportunities for LANL and partner universities to recruit, retain, and recognize premier scientists and engineers by offering them the ability to work in both the LANL and university environments. These interactions enhance the ability of both institutions to achieve their respective research and development missions while providing increased academic strength to educational institutions.

96 KNOWLEDGE MANAGEMENT AND PRESERVATION↗

Sandia and Ditch Witch Technology Commercialization Fund Integral Motor and Percussive Hammer

This report captures the results of development and testing of a integral downhole motor and percussive hammer used for drilling in near-surface hard rock formations. The work was funded through the DOE Office of Technology Transitions Technology Commercialization Fund. It was a collaboration between Sandia National Labs and The Charles Machine Works (aka Ditch Witch). In the collaboration, Sandia developed a pneumatic motor derived from an indexing tool used in other drilling applications, and Ditch Witch developed the bearing pack tied to the output shaft of the motor as well as the angled beacon housing used for directional control.

15 GEOTHERMAL ENERGY↗

Robotics Technologies on Knowledge Management Information Tool (KM-IT) Platform - 16465

The Knowledge Management Information Tool (KM-IT) is a web-based system developed to maintain and preserve the deactivation and decommissioning (D and D) knowledge base across the Department of Energy (DOE) complex. The system was developed by the Applied Research Center (ARC) at Florida International University (FIU) with the support of the D and D community, including the DOE Office of Environmental Management (DOE EM), and with the active collaboration and support of the DOE's Energy Facility Contractors Group (EFCOG). The KM-IT system is a D and D community driven system tailored to serve the technical issues faced by the D and D workforce across the DOE Complex. New information, including vendors and technologies related to D and D, are researched and added to KM-IT on an ongoing basis. In late 2014, DOE EM provided a database of 471 robotic technologies, originally developed by NuVision Engineering and Cogentus Consulting, with a request to evaluate the potential for integrating the data into the KM-IT framework for ongoing hosting/maintenance of the information. All of the data from the original database as well as photographs, documents, and videos are now available on KM-IT. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Four-harmonic buncher for radioactive and stable beams switching at the ATLAS facility [Four-harmonic buncher for radioactive and stable beams combination at the ATLAS facility]

Here, the Argonne Tandem Linac Accelerator System (ATLAS) is planning an upgrade to a multi-user facility to simultaneously accelerate both stable beams from an ECR ion source and radioactive beams from an Electron Beam Ion Source charge breeder. The ATLAS Multi-User Upgrade will need to provide high transmission of ion beams with a mass-to-charge ratio up to 7 as it enables more options to alternate radioactive and stable beams. Currently, the bunching is provided with a lumped circuit multi-harmonic buncher, which cannot effectively operate at the required amplitude of the saw-tooth voltage for ions with mass-to-charge ratio of 7 due to thermal issues. RadiaBeam Systems in collaboration with Argonne National Laboratory has designed a four-harmonic coaxial resonator buncher with the ATLAS fundamental frequency of 12.125 MHz, and a compact, less than 2-m-long, footprint, capable of providing the required voltage of 6.2 kV. This device allows fast and reliable pre-bunching of DC ion beams with the capability of fast switching of heavy-ion radioactive and stable beams for delivery to multiple users. In this paper, we will discuss the RF and engineering design considerations of this buncher.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Isotope Production at the Jefferson Lab LERF Facility

The project initially proceeded well, meeting all of the Milestones. However, the need to create a new irradiation area in the LERF (the initial proposal was to use the CEBAF Injector) used up a larger fraction of the budget than foreseen. A further problem arose when the hot-cell became unavailable at VCU, followed by VCU dropping out of the collaboration. This meant that we were unable to separate the 67 Cu from the gallium. We replaced this by carrying out detailed gamma spectroscopy to determine the quantity of 67 Cu produced. This work was published as presentations in November of 2021 by the two doctoral students (Geno Santistevan and Robert Bentley) and proceedings articles for American Nuclear Society’s topical meeting AccApp21 (https://www.ans.org/pubs/proceedings/issue-3206/), as well as in invited, expanded versions in the peer-reviewed journal “Nuclear Science and Engineering”. Geno and Robert have subsequently successfully leveraged this research to achieve “doctoral candidacy” status and are expected to defend their dissertations in the Fall of 2023.

07 ISOTOPE AND RADIATION SOURCES↗

Regional Manufacturing Cost Structures and Supply Chain Considerations for Medium Voltage Silicon Carbide Power Applications

Bottoms-up cost analysis has been a mainstay of commoditized industry and manufacturing processes for years, however a holistic objective supply chain analysis to inform research and investment in the development of early stage technologies has not. The potential for rapid adoption of wide bandgap (WBG) semiconductors, specifically silicon carbide (SiC), highlights a need to understand the drivers of location-specific manufacturing cost, global supply chains, and plant location decisions. Further, ongoing research and investment, necessitates analytical analysis to help inform the roadmap of SiC technologies. In collaboration with PowerAmerica the project explores the bottoms-up cost analysis of wafers, devices, modules, and motor drives at the anticipated manufacturing levels. Leveraging these models, it outlines how the cost reduction potential of proposed research advances can be quantified.

42 ENGINEERING↗