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At least 1,279 records · Page 71

Lawrence Livermore National Laboratory- Completing the Human Genome Project and Triggering Nearly $1 Trillion in U.S. Economic Activity

The success of the Human Genome project is already nearing $1 Trillion dollars of U.S. economic activity. Lawrence Livermore National Laboratory (LLNL) was a co-leader in one of the biggest biological research effort in history, sequencing the Human Genome Project. This ambitious research effort set out to sequence the approximately 3 billion nucleotides in the human genome, an effort many thought was nearly impossible. Deoxyribonucleic acid (DNA) was discovered in 1869, and by 1943 came the discovery that DNA was a molecule that encodes the genetic instructions used in the development and functioning of living organisms and many viruses. To make full use of the information, scientists needed to first sequence the billions of nucleotides to begin linking them to genetic traits and illnesses, and eventually more effective treatments. New medical discoveries and improved agriculture productivity were some of the expected benefits. While the potential benefits were vast, the timeline (over a decade) and cost ($3.8 Billion) exceeded what the private sector would normally attempt, especially when this would only be the first phase toward the path to new discoveries and market opportunities. The Department of Energy believed its best research laboratories could meet this Grand Challenge and soon convinced the National Institute of Health to formally propose the Human Genome project to the federal government. The U.S. government accepted the risk and challenge to potentially create new healthcare and food discoveries that could benefit the world and the U.S. Industry.

59 BASIC BIOLOGICAL SCIENCES↗

2014 Well Completion Report for Corrective Action Unit 447 Project Shoal Area Churchill County, Nevada October 2015

This report summarizes the drilling program conducted by the U.S. Department of Energy (DOE) Office of Legacy Management at the Project Shoal Area (Shoal) Subsurface Corrective Action Unit 447 in Churchill County, Nevada. Shoal was the location of an underground nuclear test conducted on October 26, 1963, as part of the Vela Uniform program sponsored jointly by the U.S. Department of Defense and the U.S. Atomic Energy Commission (a predecessor to DOE). The test consisted of detonating a 12-kiloton nuclear device in granitic rock at a depth of approximately 1,211 feet (ft) below ground surface (bgs) (AEC 1964). The corrective action strategy for the site is focused on revising the site conceptual model and evaluating the adequacy of the monitoring well network at the site. Field activities associated with the project were conducted in accordance with the Federal Facility Agreement and Consent Order (FFACO 1996, as amended) and applicable Nevada Division of Environmental Protection (NDEP) policies and regulations.

54 ENVIRONMENTAL SCIENCES↗

Complete Non-Radioactive Operability Tests for Cladding Hull Chlorination

Non-radioactive operability tests were made to test the metal chlorination reactor and condenser and their accessories using batch chlorinations of non-radioactive cladding samples and to identify optimum operating practices and components that need further modifications prior to installation of the equipment into the hot cell for tests on actual used nuclear fuel (UNF) cladding. The operability tests included (1) modifications to provide the desired heating and reactor temperature profile; and (2) three batch chlorination tests using, respectively, 100, 250, and 500 g of cladding. During the batch chlorinations, metal corrosion of the equipment was assessed, pressurization of the gas inlet was examined and the best method for maintaining solid salt product transfer through the condenser was determined. Also, additional accessing equipment for collection of residual ash and positioning of the unit within the hot cell were identified, designed, and are being fabricated.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

A kinematically complete, interdisciplinary, and co-institutional measurement of the 19 F(α,n) cross section for nuclear safeguards science

Alpha particles emitted from the decay of uranium in a UF 6 matrix can interact with fluorine and generate neutrons via the 19 F(α,n) 22 Na reaction. These neutrons can be used to determine the uranium content in a UF 6 storage cylinder. The accuracy of this self-interrogating, non-destructive assay (NDA) technique is, however, limited by the uncertainty of the 19 F(α,n) 22 Na cross section. We have performed complementary measurements of the 19 F(α,n) 22 Na reaction with both 4 He and 19 F beams to improve the precision of the 19 F(α,n) 22 Na cross section over the alpha energy range that encompasses common actinide alpha decay needed for NDA studies. We have determined an absolute cross section for the 19 F(α,n) 22 Na reaction to an average precision of 7.6% over the alpha energy range of 3.9 – 6.7 MeV. We utilized this cross section in a simulation of a 100 g spherical UF 6 assembly and obtained a change in neutron emission rate values of approximately 10-12%, and a significant (factor of 3.6) decrease in the neutron emission rate uncertainty (from 50-51% to 13-14%), compared to simulations using the old cross section. Our new absolute cross section enables improved interpretations of NDAs of containers of arbitrary size and configuration.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Complete Status Report Documenting Weld Development for Thin Wall Tubing of ODS Ferritic Alloys

Beginning in 2015, research in the FCRD program began the development of FSW for joining thin sections of 14YWT in the form of thin (0.5 mm) plate and ultimately thin wall tubing. In the previous fiscal year, a ~1 mm thick plate, or sheet, of 14YWT was produced by hot rolling with no edge cracking. The initial FSW experiment was performed on the 1 mm thick plate and involved a bead-on-plate weld in which the spinning pin tool is plunged into the plate surface, but does not penetrate the thickness of the plate, and then travels the length of the plate. The FSW run successfully produced a bead-on-plate stir zone on the 1 mm thick plate of 14YWT, but no characterization studies of the stir zone were performed by the end of FY15. Therefore, the results presented in this report cover the microstructural analysis of the bead-on-plate stir zone and the initial research task on obtaining tensile properties of the stir zone using the digital image correlation (DIC) approach during testing of miniature tensile specimens to assess the quality of the FSW parameters used in the initial experiment. The results of the microstructural characterization study using optical, scanning electron and scanning transmission electron microscopies showed the grain structure in the SZ to have isotropic and irregular shape but very similar size compared to the highly elongated grains oriented horizontally with the plane of the plate that were observed in the unaffected zone of 14YWT. Several cracks oriented horizontally were observed mostly on the retreating side of the SZ in both the SZ and TMAZ. These cracks may have formed due to insufficient pressure being exerted on the top surface of the plate by the shoulder and pin tool during the FSW run. High resolution STEM-EDS analysis showed the presence of the Y-Ti-O particles in the SZ, but that some particles exhibited coarsening. Overall, the FSW parameters used to produce the bead-on-plate SZ in the 0.1 cm thick plate of 14YWT were nearly optimized. The results of the digital image correlation (DIC) analysis of the two SS-Mini-2 tensile specimens fabricated from the 0.1 cm thick plate of 14YWT showed that the specimens exhibited high strength and good ductility. However, strain localization occurred in one of the specimens during the tensile test that was too close to the grips, which invalidated the data from the DIC analysis. This was surprising since the abrupt crack pop-in that occurred in the 0.1 cm thick plate of 14YWT during fabrication by wire EDM suggested that residual stresses were high. Residual stress measurements and the effects of post weld heat treatment on the FSW quality of joined 14YWT plates will be investigated in the next FW work package.

36 MATERIALS SCIENCE↗

Complete Sensitivity/Uncertainty Analysis of LR-0 Reactor Experiments with MSRE FLiBe Salt and Perform Comparison with Molten Salt Cooled and Molten Salt Fueled Reactor Models

In September 2016, reactor physics measurements were conducted at Research Centre Rez (RC Rez) using the FLiBe (2 7 LiF + BeF 2 ) salt from the Molten Salt Reactor Experiment (MSRE) in the LR-0 low power nuclear reactor. These experiments were intended to inform on neutron spectral effects and nuclear data uncertainties for advanced reactor systems using FLiBe salt in a thermal neutron energy spectrum. Oak Ridge National Laboratory (ORNL), in collaboration with RC Rez, performed sensitivity/uncertainty (S/U) analyses of these experiments as part of the ongoing collaboration between the United States and the Czech Republic on civilian nuclear energy research and development. The objectives of these analyses were (1) to identify potential sources of bias in fluoride salt-cooled and salt-fueled reactor simulations resulting from cross section uncertainties, and (2) to produce the sensitivity of neutron multiplication to cross section data on an energy-dependent basis for specific nuclides. This report provides a final report on the S/U analyses of critical experiments at the LR-0 Reactor relevant to fluoride salt-cooled high temperature reactor (FHR) and liquid-fueled molten salt reactor (MSR) concepts. In the future, these S/U analyses could be used to inform the design of additional FLiBe-based experiments using the salt from MSRE. The key finding of this work is that, for both solid and liquid fueled fluoride salt reactors, radiative capture in 7 Li is the most significant contributor to potential bias in neutronics calculations within the FLiBe salt.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Complete Evaluation of Available Laboratory-scale Data for the Independence Model

Year 1 Objectives (August 2016 – December 2016) – The original Independence model is a sequentially regressed set of parameters from numerous data sets in the Aspen Plus modeling framework. The immediate goal with the basic data model is to collect and evaluate those data sets relevant to the thermodynamic submodels (pure substance heat capacity, solvent mixture heat capacity, loaded solvent heat capacities, and volatility data). These data are informative for the thermodynamic parameters involved in both vapor-liquid equilibrium, and in the chemical equilibrium of the liquid phase.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Milestone Completion Report STCO04-1 AAPS: engagements with code teams, vendors, collaborators, developers

The Advanced Architecture and Portability Specialists team (AAPS) worked with a select set of LLNL application teams to develop and/or implement a portability strategy for next-generation architectures. The team also investigated new and updated programming models and helped develop programming abstractions targeting maintainability and performance portability. Significant progress was made on both fronts in FY17, resulting in multiple applications being significantly more prepared for the nextgeneration machines than before.

97 MATHEMATICS AND COMPUTING↗

Complete Status Report Documenting Development of Friction Stir Welding for Joining Thin Wall Tubing of ODS Alloys

The development of friction stir welding (FSW) for joining thin sections of the advanced oxide dispersion strengthened (ODS) 14YWT ferritic alloy was initiated in Fuel Cycle Research and Development (FCRD), now the Nuclear Technology Research and Development (NTRD), in 2015. The first FSW experiment was conducted in late FY15 and successfully produced a bead-on-plate stir zone (SZ) on a 1 mm thick plate of 14YWT (SM13 heat). The goal of this research task is to ultimately demonstrate that FSW is a feasible method for joining thin wall (0.5 mm thick) tubing of 14YWT.

36 MATERIALS SCIENCE↗

Completion of the Irradiation of Silicon Carbide Cladding Tube Specimens in the High Flux Isotope Reactor

This document outlines the irradiation of silicon carbide cladding tube specimens in the High Flux Isotope Reactor at Oak Ridge National Laboratory. The cladding tube specimens consisted of monolithic, composite, and coated SiC specimens in order to test the effect of these various materials on the overall cladding performance during irradiation. A total of 18 specimens were irradiated for one cycle, with 9 specimens irradiated at low heat flux conditions and 9 specimens at high heat flux conditions. The specimens were inserted in cycle 475 in September 2017 and reached an average irradiation dose of approximately 2.6 dpa.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Predicting Selectivity of Uranium vs. Vanadium from First Principles: Complete Molecular Design and Adsorption Modeling

Uranium is used as the basic fuel for nuclear power plants, which generate significant amounts of electricity and have life cycle carbon emissions that are as low as renewable energy sources. The extraction of this valuable energy commodity from the ground remains controversial, however, mainly because of environmental and health impacts. Alternatively, seawater offers an enormous uranium resource that may be tapped at minimal environmental cost. Currently, amidoxime polymers are the most widely considered adsorbent materials for large-scale extraction of uranium from seawater, but they are not perfectly selective for uranyl, UO 2 2+ . In particular, the competition between UO 2 2+ and vanadium (VO 2+ /VO 2 + ) cations poses a significant challenge to the efficient mining of UO 2 2+ . Thus, accelerating progress in the discovery and deployment of advanced materials for the recovery of uranium relies on the design of new ligands with high binding affinity and selectivity for uranium over competing metal ions. A cost-effective route to aid the discovery of new ligands is to apply computational methods to rapidly test attractive candidates and elucidate data-driven guidelines for rational design.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Light Water Reactor Sustainability Program: Report on the Completion of the Machining of Zion Unit 1 Reactor Pressure Vessel Blocks into Mechanical and Microstructural Test Specimens and Chemical Analysis Coupons

The decommissioning of the Zion Units 1 and 2 Nuclear Generating Station in Zion, Illinois, presented a unique opportunity for developing a better understanding of materials degradation and other issues associated with extending the lifetime of existing nuclear power plants (NPPs) beyond 60 years of service. In support of extended service and current operations of the US nuclear reactor fleet, the Oak Ridge National Laboratory (ORNL), through the Department of Energy (DOE), Light Water Reactor Sustainability (LWRS) Program, coordinated with Zion Solutions, LLC, a subsidiary of Energy Solutions (ES), the selective procurement of materials, structures, and components, from the decommissioned reactors including multiple segments of the Zion Unit 1 Reactor Pressure Vessel (RPV).

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Geothermal Drilling and Completions: Petroleum Practices Technology Transfer

In the summer of 2013, members of the National Renewable Energy Laboratory (NREL) and Colorado School of Mines (CSM) identified an opportunity to improve geothermal drilling operations by transferring practices from the petroleum drilling field. The NREL/CSM group noted that significant changes in drilling efficiencies in petroleum operations have been made during the last decade. For example, five years ago, 14,000-foot wells in Wyoming took 60 days to drill. However, in September of 2015, these same wells were drilled in 7 days. This significant decrease in required drilling days resulted from analysis, goal setting, and management and technology improvements. The geothermal drilling industry can import these methods and technologies, where appropriate, with the possibility of similar improvements in drilling operations.

15 GEOTHERMAL ENERGY↗

Complete Status Report Documenting the Development of Friction Stir Welding for Producing a Butt Joint in Thin Wall Tubing of ODS Alloys

A challenging attempt using friction stir welding to produce a butt joint between two 1.0 mm thick plates of 14YWT was nearly successful. The modified tool pin mostly penetrated the thickness of the adjoined thin plate samples resulting in a small blunt notch on the bottom surface of the butt joint. A bend occurred in the thin plate sample due to formation of stresses from clamping the thin plate sample during FSW. The peak displacement of the bend occurred along the center line of the butt joint. The weld zone showed good microstructure mixing with some flashing mostly on the retreating side that suggested excess heat input by friction between the traveling and spinning tool pin and thin plates of 14YWT. Neutron diffraction experiments were performed on the bent sample of 14YWT to measure the residual stresses in the butt joint on the HB-2B beam line at the Neutron Residual Stress Facility at HFIR. However, the neutron scattering to background noise ratio was very low during data acquisition. Measurements of lattice strains were obtained in the rolling (RD) and normal (ND) directions but not in the extrusion direction (ED) of the thin plate sample. Unfortunately, the quality of the data was not sufficient for determining the residual stresses in the butt joint. From the previous neutron scattering experiments conducted on four hot rolled plates (R1, R2, R3 and R4) of 14YWT, the residual stresses were calculated from lattice strain data and plotted in 2-D color contour maps for ED, RD and ND. The results showed variations in the magnitude and spatial position of residual stresses in the microstructure of the four plates. The magnitude in residual stresses in ED and RD increased gradually with increasing rolling deformation for R1 (50%) to R2 (76%), followed by larger increases in R3 (89%) and R4 (95%). The maximum peaks in residual stresses for R4 was ~710-730 MPa in ED and RD. The residual stresses in ND were below ~300 MPa for each of the 4 rolled plates, with a maximum residual stress in R4 (95%) of ~400 MPa. These results indicated that significant residual stresses representing ~57% of the yield stress of 14YWT (SM13) had accumulated in the 14YWT plate after hot rolling to the 1 mm thickness, which was used in the FSW experiments. The microstructure analysis of the 1.0 mm thick plate of 14YWT containing the butt joint produced by FSW revealed significant changes in the grain structure and texture between the unaffected zone (UZ) of the rolled plate and the butt joint weld. In the UZ, the grains were severely elongated after 95% deformation and mainly possessed the {101} texture component in the ED. Two predominant grain misorientation angles were observed: one consisting of small misorientations of <5º between highly elongated grains and the other consisting of large misorientations of >15º in pockets of small grains that might have formed by dynamic recrystallization processes during rolling of the plate at 1000ºC. The morphology and texture of grains in the heat affected zone (HAZ) were similar to those in UZ, except the grains had coarsened due to excess heat input during FSZ. A population of pores formed and the grains both coarsened and changed to isotropic morphology in the microstructure of the butt joint on both the advancing and retreating sides. The texture of grains in both regions were randomly orientated between the 3 poles {001}, {101} and {111}. The main difference in texture of grains between the advancing side and retreating side was with the misorientation angles of neighboring grains. Most of the grains in the advancing side had misorientation angles of >5º indicating that these grains experienced recrystallization. On the retreating side, areas containing larger grains showed high misorientation angles of >15º compared to areas appearing as bands of grains with misorientation angles of <5º and between 5º-15º. Numerous small pockets of grains with low misorientation angles of <5º were distributed in the microstructure among the grains showing high misorientation angles of >15º. It was determined that the grains associated with low misorientation angles contained sub-grain structures, which was consistent with both recrystallization and recovery mechanisms for grains located on the retreating side of the butt joint. These results demonstrate the complex microstructure that evolves in the microstructure of 14YWT resulting from the input of high temperatures and severe deformations during FSW.

36 MATERIALS SCIENCE↗

Light Water Reactor Sustainability Program: Complete Report on Development of Weld Repair Technology

This report summarizes recent post-welding activities on irradiated alloys at the Irradiated Materials Examination and Testing (IMET) and the Low Activation Materials Development and Analysis (LAMDA) facilities at Oak Ridge National Laboratory. Equipment and capabilities were developed jointly by the U.S. Department of Energy, Office of Nuclear Energy, Light Water Reactor Sustainability Program, the Electric Power Research Institute, Long Term Operations Program (and the Welding and Repair Technology Center), and Oak Ridge National Laboratory. The preliminary helium measurements and microstructure characterization revealed successful advanced laser and friction stir welding procedures on high helium content stainless steel. The significant, on-going effort to weld irradiated alloys with high helium concentrations and comprehensively analyze the results will eventually yield validated repair techniques and guidelines for use by the nuclear industry in extending the operational lifetimes of nuclear power plants. The nuclear industry welding workshop was successfully held at ORNL on September 18 – 19, 2018.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Well hydraulic fracture completion

Hydraulic fracturing (fracking) of a horizontal well. To access the model referenced in the report, please visit https://www.netl.doe.gov/energy-analysis/details?id=98ADBAD7-12CD-46F5-B43A-6271357C5A53

58 GEOSCIENCES↗

Completed coarse-grained model for Pu hydriding that has quantum accuracy (Progress Summary)

Our team has developed a highly computationally efficient coarse-grained model for PuH 2 formation, based on high-level quantum mechanical calculations. Kohn-Sham Density Functional Theory (DFT) is a quantum mechanical approach that can be highly accurate for modeling condensed phases, including reactive materials that are subject to the breaking and forming of chemical bonds. DFT calculations, though, are extremely computationally intensive, and are generally limited to exceedingly small system sizes and time scales. This is particularly true for f-electron solids such as plutonium, where the high computational effort due to electron correlations and minimizing to specific electronic spin-states (e.g., anti-ferromagnetic vs. ferromagnetic) limits standard calculations to systems of tens of atoms and precludes the determination of time-dependent properties (e.g., chemical kinetic data). In this regard, we have created a simplified Pu + H 2 /PuH 2 equilibrium model based on a small number of interaction energies determined from DFT calculations. We have determined that Pu-H bond energetics in the bulk are largely defined by nearest-neighbor interactions, only. In other words, a hydrogen atom in a d-Pu tetrahedral interstitial site will only experience perturbations to its H-Pu bonded interactions when there is an additional hydrogen ion in a directly adjacent adsorption site. This is due to the strong electronic screening from the Pu atoms, which essentially limits the spatial extent of how hydrogen ions interact with each other within the Pu lattice. As a result, we are able to pre-tabulate all essential Pu-H interaction energies and model PuH 2 formation via a Monte Carlo simulation approach. This allows us to greatly expand the spatial and time scales of our calculations while maintaining most of the accuracy of quantum methods. Our model can thus be extended to system sizes if 100,000 atoms or greater and can be used to model hydride equilibrium processes, all of which are computationally cost prohibitive with any standard quantum code. We have used our approach to compute a two-dimensional free energy heat map and temperature dependence at sub-atmospheric pressures for PuH 2 formation. Our results compare well to the limited available experimental data, in particular for the enthalpy of formation (DH). Our goal is to extend these results to compute nucleation parameters such as the critical nucleus size and nucleation growth rates for continuum models.

36 MATERIALS SCIENCE↗