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At least 919 records · Page 51
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

3D modeling of missing pellet surface defects in BWR fuel

One of the important roles of cladding in light water reactor fuel rods is to prevent the release of fission products. To that end, it is essential that the cladding maintain its integrity under a variety of thermal and mechanical loading conditions. Local geometric irregularities in fuel pellets caused by manufacturing defects known as missing pellet surfaces (MPS) can in some circumstances lead to elevated cladding stresses that are sufficiently high to cause cladding failure. Accurate modeling of these defects can help prevent these types of failures. The BISON nuclear fuel performance code developed at Idaho National Laboratory can be used to simulate the global thermo-mechanical fuel rod behavior, as well as the local response of regions of interest, in either 2D or 3D. In either case, a full set of models to represent the thermal and mechanical properties of the fuel, cladding and plenum gas is employed. A procedure for coupling 2D full-length fuel rod models to detailed 3D models of the region of the rod containing a MPS defect is detailed in this paper. The global and local model each contain appropriate physics and behavior models for nuclear fuel. This procedure is demonstrated on a simulation of a boiling water reactor (BWR) fuel rod containing a pellet with an MPS defect, subjected to a variety of transient events, including a control blade withdrawal and a ramp to high power. The importance of modeling the local defect using a 3D model is highlighted by comparing 3D and 2D representations of the defective pellet region. Finally, parametric studies demonstrate the effects of the choice of gaseous swelling model and of the depth and geometry of the MPS defect on the response of the cladding adjacent to the defect.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2023

Editorial: Benchmark experiments, development and needs in support of advanced reactor design

Advanced nuclear reactor designs will for the most part be a departure from low enrichment light water reactor (LWR) designs currently operated around the world. Such advanced designs include but are not limited to new TRISO-fueled high temperature gas reactors, heat-pipe cooled micro-reactors, fluoride salt cooled high-temperature reactors, molten salt reactors, lead cooled fast reactors, nuclear thermal propulsion concepts, and include LWR designs with advanced fuel and clad types. Modeling and simulation methods for advanced reactors is necessary for regulators to approve license requests. However, regulators also require that modeling approaches be validated against experimental measurements. Hence, there is a crucial need for data for advanced reactor systems that will support validation of analysis methods. To this end, this Research Topic includes eleven papers organized into topical seven categories relevant for advanced reactor design.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2022

Sister Rod Destructive Examinations (FY2021) Appendix B: Segmentation, Defueling, Metallographic Data and Total Cladding Hydrogen

As a part of the DOE-NE High Burnup Spent Fuel Data Project, Oak Ridge National Laboratory (ORNL) is performing destructive examinations (DEs) of high burnup (HBU) (>45 GWd/MTU) spent nuclear fuel (SNF) rods from the North Anna Nuclear Power Station operated by Dominion Energy. The SNF rods, called sister rods or sibling rods are all HBU and include four different kinds of fuel rod cladding: standard Zircaloy-4 (Zirc-4), low-tin (LT) Zirc-4, ZIRLO®, and M5®. Appendix B provides detailed information regarding defueling activities, metallographic imaging and measurements, and total cladding hydrogen measurements.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2016

Advantages gained by Optimized ZIRLO and AXIOM PWR cladding materials

In support of industry's demands for higher performance cladding alloy materials, the Optimized ZIRLO alloy was developed as an evolutionary improvement of the ZIRLO alloy to obtain a significant improvement in corrosion performance and hydrogen pickup while maintaining the overall robust performance of ZIRLO alloy. Currently with operating experience in over 40 plants and burnup reaching over 70 GWd/MTU, a majority of the Westinghouse-fueled US PWR fleet, covering almost all Westinghouse fuel designs, has adopted full regions of Optimized ZIRLO cladding. Across all of these applications, Optimized ZIRLO cladding has demonstrated greatly improved corrosion performance and structural stability. These demonstrated improvements offer increased operational margin and flexibility, in support of industry trends toward increased core operating fuel duties and evolving regulatory requirements such as accident scenarios. Underpinning these benefits are the extensive post irradiation exam (PIE) data obtained from both pool-side and hot-cell exams for Optimized ZIRLO cladding. Building on the successes of Optimized ZIRLO cladding, and in recognition of increasingly challenging fuel management practices, and revised LOCA regulatory rules restricting cladding hydrogen content, AXIOM cladding is being rolled out for full lead test assembly irradiation. The AXIOM alloy, Westinghouse's next generation robust alloy targeting very high fuel duties, is designed to provide improved corrosion resistance, lower hydrogen pick-up, and lower creep and growth compared to current Westinghouse products. AXIOM cladding has been irradiated in a variety of reactors worldwide, including both commercial and test reactors. Extensive PIE data is available for various burnup levels, with leading rods approaching 75 GWd/MTU. The AXIOM composition was selected to ensure enhanced operating performance on multiple fronts, including the optimum combination of corrosion resistance and wear resistance, reduced hydrogen pick-up, improved dimensional stability, and robustness in aggressive coolant chemistry conditions. The present paper provides high burnup performance data, capturing the advantages gained by introducing Optimized ZIRLO and AXIOM alloy as PWR cladding materials. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2016

Development of Zirconium-Silicide Coatings for Improved Performance Zirconium-Alloy Fuel Cladding

There is considerable interest in the development of coatings for zirconium-alloy fuel cladding used in light water reactors (LWR) to improve their oxidation resistance during high temperature accident conditions and to enhance performance under normal operating conditions. These coatings should also enhance the heat transfer characteristics of the cladding surface so that heat from the fuel rod is efficiently transferred into the water coolant. One potential candidate coating material is zirconium-silicide. Transition metal silicides have been generally shown to have outstanding oxidation resistance. Zirconium-silicide is particularly attractive because Zr is strongly oxophilic, so that the Zr-silicide layer is expected to bond more strongly to the inner, native ZrO{sub 2} layer. The relative proximity of the free energy of formation of oxides of Zr and Si can lead to alternating multilayered oxide structures with radiation damage resistance. Additionally, oxidation of zirconium silicide can produce excellent corrosion resistant glassy zircon (ZrSiO{sub 4}) and silica (SiO{sub 2}), possessing self-healing qualities. This paper reports results of our results of high temperature oxidation tests of bulk zirconium-silicide and coatings of zirconium-silicide deposited on zirconium-alloy test flats and cladding tube configurations using plasma vapor deposition (PVD) process. We also report our initial results on the experimental facility for studying boiling characteristics of coated cladding tubes in prototypic pressurized water conditions. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2023

Sister Rod Destructive Examinations (FY22) Appendix B: Segmentation, Defueling, Metallographic Data and Total Cladding Hydrogen

This report documents work performed under the Spent Fuel and Waste Disposition’s Spent Fuel and Waste Science and Technology program for the US Department of Energy (DOE) Office of Nuclear Energy (NE). This work was performed to fulfill Level 2 Milestone M2SF-23OR010201024, “FY22 Report on ORNL Sibling Rod Testing Results,” within work package SF-23OR01020102 and is an update to the work reported in M2SF-22OR010201047, M2SF-21OR010201032, M2SF-19ORO010201026, and M2SF 19OR010201028. As a part of the DOE-NE High Burnup Spent Fuel Data Project, Oak Ridge National Laboratory (ORNL) is performing destructive examinations (DEs) of high burnup (HBU) (>45 GWd/MTU) spent nuclear fuel (SNF) rods from the North Anna Nuclear Power Station operated by Dominion Energy. The SNF rods, called sister rods or sibling rods are all HBU and include four different kinds of fuel rod cladding: standard Zircaloy-4 (Zirc-4), low-tin (LT) Zirc-4, ZIRLO ® , and M5 ® . Appendix B provides detailed information regarding defueling activities, metallographic imaging and measurements, and total cladding hydrogen measurements.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2021

Hydrothermal corrosion of laser printed SiC fibers under extreme environment

We report SiC/SiC fiber composites are proposed cladding materials to improve the accident tolerance of commercial light water nuclear reactor fuel. To evaluate their viability, understanding the kinetics of corrosion under irradiation and high-temperature, high-pressure aqueous environment is critical. In the present work, the microstructure and mechanical properties of novel SiC fibers manufactured by Laser Chemical Vapor Deposition (LCVD) are introduced. The LCVD technology has control over microstructure and stoichiometry while allowing for high purity manufacturing, all key qualities needed in search of an optimum SiC fiber for nuclear energy applications. The isolated hydrothermal corrosion of commercially available carbon-rich Hi-Nicalon Type-S fibers is compared to the LCVD stoichiometric and LCVD silicon-rich fibers. Autoclave testing was carried out at 310°C and 14 MPa in the absence of irradiation. In a separate study, the effect of gamma irradiation on the fibers in the room-temperature environment was analyzed. It was observed from the experiments that the dissolution of the fibers was highly dependent on the stoichiometric ratio, fiber surface morphology and thermal pre-treatment of fibers. Contrary to previous findings, fiber dissolution was also visible under low-temperature gamma irradiation in aqueous environment with LCVD fibers showing lower dissolution.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Verification of Pilger Mill Performance

The Nuclear Technology Research & Development program of the Office of Nuclear Energy has implemented a program to develop an advanced reactor cladding fabrication capability by using the extrusion and pilgering processes. Oxide-dispersion strengthened (ODS) steels are a promising class of advanced materials, but processes need to be developed to produce tubing for these advanced alloys. The Pacific Northwest National Laboratory (PNNL) has converted its rolling mill into a lab-scale pilger mill, which required designing pilger tooling and rolls that contained multiple pilgering grooves and designing a servo-driven feed mechanism. Upon assembling and checking out the system, initial pilgering runs were completed. This report will provide verification of the design and performance of the lab-scale pilger mill.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Irradiation - High heat flux synergism in silicon carbide-based fuel claddings for light water reactors

Silicon carbide-based fuel cladding for light water reactors is anticipated to develop a unique stress state as a combined result from the high radial heat flux and irradiation-induced swelling assisted by thermal conductivity decrease. In order to verify the multi-physics finite-element analysis of this unique stress state, a novel experiment capturing the synergism of a high radiation field and a high radial heat flux in tubular silicon carbide specimens had been designed and implemented in the High Flux Isotope Reactor, Oak Ridge National Laboratory. In this experiment, small diameter tube test specimens made of monolithic or composite silicon carbide were irradiated to a dose of ∼2x10{sup 25} n/m{sup 2} (E > 0.1 MeV) under a radial heat flux of ∼0.6 MW/m{sup 2} while the outer surface temperature was maintained at a target temperature of about 300 Celsius degrees achieving a steep temperature gradient through the cladding wall thickness. The primary objective of the present paper is to discuss the technical planning and execution of the experiment. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2017

Experimental design and analysis for irradiation of SiC/SiC composite tubes under a prototypic high heat flux

The purpose of this work is to design an irradiation vehicle for testing silicon carbide (SiC) fiber-reinforced SiC matrix composite cladding materials under conditions representative of a light water reactor in order to validate thermo-mechanical models of stress states in these materials due to irradiation swelling and differential thermal expansion. The design allows for a constant tube outer surface temperature in the range of 300–350 °C under a representative high heat flux (~0.66 MW/m 2 ) during one cycle of irradiation in an un-instrumented “rabbit” capsule in the High Flux Isotope Reactor. An engineered aluminum foil was developed to absorb the expansion of the cladding tubes, due to irradiation swelling, without changing the thermal resistance of the gap between the cladding and irradiation capsule. Finite-element analyses of the capsule were performed, and the models used to calculate thermal contact resistance were validated by out-of-pile testing and post-irradiation examination of the foils and passive SiC thermometry. Six irradiated cladding tubes (both monoliths and composites) were irradiated and subsequently disassembled in a hot cell. The calculated temperatures of passive SiC thermometry inside the capsules showed good agreement with temperatures measured post-irradiation, with two calculated temperatures falling within 10 °C of experimental measurements. Furthermore, the success of this design could lead to new opportunities for irradiation applications with materials that suffer from irradiation swelling, creep, or other dimensional changes that can affect the specimen temperature during irradiation.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2016

A study of transient FGR by integral LOCA tests

A study of transient fission gas release (FGR) was performed by means of two out-of-pile LOCA tests in a hot cell facility. Irradiated fuel rod segments with lengths of roughly 80 mm and burnups of 64 MWd/kgU were subjected to simulated water-cooled reactor LOCA transients in an integral LOCA test device. The segments were heated to a maximum temperature of 1000 Celsius degrees and the increase in rod inner pressure resulting from fission gas release and increased gas temperature during the transient was measured. The first release of gas occurred at temperatures close to 450 Celsius degrees, which suggests a burst release mechanism that may be linked to the onset of grain boundary fracturing. At the end of the simulated transients, gas samples were taken from the fuel rod segments for study by gas mass spectroscopy. The transient fission gas release was measured and amount to roughly 13 % of the calculated pre-test rod inventory of Kr and Xe. Isotopic ratios of the released gas indicated that transient FGR originated from the whole pellet and not only the pellet periphery. The tested segments were also studied by light-optical microscopy to determine pellet porosity, pellet crack pattern and fuel fragmentation. The extent of fine fuel fragmentation was found to be small and limited to the periphery of the fuel. The determined amount of transient fission gas release can be added to the database of fuel rod design codes to more accurately describe the LOCA cladding strains and burst temperatures in the future.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2012

Review of fuel/cladding eutectic formation in metallic SFR fuel pins

Sodium-cooled Fast Reactors (SFRs) remain a strong contender amongst the Generation IV reactor concepts. Metallic fuel has been a primary fuel option for SFR designers in the US and was used extensively in the first generation of SFRs. One of the benefits of metallic fuel is its chemical compatibility with the coolant; unfortunately this compatibility does not extend to steel cladding at elevated temperatures. It has been known that uranium, plutonium, and rare earths diffuse with cladding constituents to form a low melting point fuel/cladding eutectic which acts to thin the cladding once the interfacial temperature rises above the system liquidus temperature. Since the 1960's, many experiments have been performed and published to evaluate the rate of fuel/cladding eutectic formation and the temperature above which melting will begin as a function of fuel/cladding interfacial temperature, time at temperature, fuel constituents (uranium, fissium or uranium (plutonium) zirconium), cladding type (stainless steel 316, stainless steel 306, D9 or HT9), beginning of life linear power, plutonium enrichment and burnup. The results of these tests, however, remain scattered across conference and journal papers spanning 50 years. The tests used to collect this data also varied in experimental procedure throughout the years. This paper will consolidate the experimental data into four groups of similar test conditions and expand upon the testing performed for each group in detail. A companion paper in PSA 2011 will discuss predictive correlations formulated from this database. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2016

Fuel Performance Simulation of Iron-Chrome-Aluminum Cladding during Steady-State LWR Operation

During a severe accident scenario, such as a loss-of-coolant accident, a nuclear reactor may lose its capacity to cool its fuel. The fuel rod temperatures begin to increases, quickly reaching temperatures where the coolant begins to evaporate. This lowers the coolant level in the core and eventually uncovers the fuel. Without sufficient heat transfer from the fuel rods to the coolant, the temperature of the fuel and cladding will increase dramatically. In the case of traditional zirconium-based alloys, as the temperature of the cladding reaches ∼1200 deg. C the zirconium rapidly begins to oxidize with H{sub 2}O in the coolant and steam. This oxidation reaction causes both thinning of the Zr-alloy cladding as the metal reacts and releases large amounts of H{sub 2} gas into the reactor pressure vessel. In order to increase the safety margin of LWR fuel in severe accident scenarios, several alternative cladding materials have been proposed to replace the currently used zirconium-based alloys. Of these materials, there is a particular focus on select iron-chrome-aluminum (FeCrAl) alloys because of slower oxidation Kinetics in high temperature steam than zirconium-based alloys. This increased oxidation resistance may provide additional coping time to mitigate any further damage resulting from an accident. However, by changing the cladding material, the neutronic characteristics of the core will change. FeCrAl alloys exhibit thermal neutron absorption cross sections nearly ∼12-16 x greater than Zr-alloys. This decreases the reactivity of the core, subsequently decreasing the potential cycle length for operation. To counteract this, fissile material may be added in the form of increased enrichment or increased fuel mass or the cladding thickness might be decreased, effectively reducing the neutronic penalty from using the alloy. In this study, all three changes are considered. To assess the viability of FeCrAl as an alternative cladding to Zr-alloys, engineering-scale fuel performance analysis is used to monitor the cladding and integral fuel rod behavior through its operation. Ongoing work is being performed to identify key parameters essential to modeling FeCrAl alloys for LWR applications and properly model fuel compliance and stress relief mechanisms for UO{sub 2} fuel. To improve the predictive capability of fuel performance codes for FeCrAl cladding under normal operation, high-fidelity mechanistic/physics-based material models are needed. This information can be generated and improved by access to experimental data on targeted FeCrAl alloys. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2019

Enhancing TREAT’s Pulsing Capabilities Using TREAT Upgrade Fuel

The Transient Reactor Test Facility (TREAT) at Idaho National Laboratory is an air-cooled, thermal, heterogeneous facility used to test reactor materials in simulated accident conditions by inducing fission heating with intense neutron pulses. TREAT operated from 1959 until 1994 with the primary goal of testing fast reactor fuels and was brought back online in 2017 to re-establish DOE's nuclear fuels transient testing capabilities. Beginning in the late 1970s, Idaho National Laboratory worked in conjunction with other organizations to increase TREAT's capability for in-pile testing. While these upgrades had not been implemented by the time the reactor was put into standby mode, new assemblies and graphite-urania fuel blocks with increased uranium concentrations had already been designed and fabricated. This project, as part of Idaho National Laboratory's Department of Reactor Physics, modeled the TREAT Upgrade (TU) fuel assemblies in MCNP and implemented them in an existing TREAT model. Calculations were performed using INL's high performance computer to find a critical combination of TU and standard fuel and this geometry's excess reactivity. Future work will include calculating a power coupling factor in the experiment, determining power peaking factors throughout the core, and assessing how much reactivity would be added by replacing the Inconel-625 cladding with silicon carbide.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2023

Advanced Drying Cycle Simulator Thermal Response to Commercial Drying Conditions

The purpose of this report is to document updates on testing of the apparatus built to simulate commercial drying procedures for spent nuclear fuel at the Nuclear Energy Work Complex at Sandia National Laboratories. Validation of the extent of water removal in a dry spent nuclear fuel storage system based on drying procedures used at nuclear power plants is needed to close existing technical gaps. Operational conditions leading to incomplete drying may have potential impacts on the fuel, cladding, and other components in the system during subsequent storage and disposal. A general lack of data suitable for model validation of commercial nuclear canister drying processes necessitates well-designed investigations of drying process efficacy and water retention that incorporate relevant physics and well-controlled boundary conditions. This report documents testing updates for the Advanced Drying Cycle Simulator (ADCS). This apparatus was built to simulate commercial drying procedures and quantify the amount of residual water remaining in a pressurized water reactor (PWR) fuel assembly after drying. The ADCS was constructed with a prototypic 17×17 PWR fuel skeleton and waterproof heater rods to simulate decay heat. These waterproof heaters are the next generation design to heater rods developed and tested at Sandia National Laboratories in FY20. This report describes preliminary testing of the ADCS through measurement and analysis of the thermal response of the system to a subset of commercial drying conditions that exclude the introduction of water, namely simulated decay heats and pressures relevant to commercial drying. This test series, referred to as a “dry” test series in this report, spans three uniform waterproof heater rod powers (representing spent fuel decay heats), four helium fill pressures, and six vacuum levels. This test series was conducted to cover the range of expected ADCS testing conditions for upcoming “wet” testing, where water will be introduced and a simulated commercial drying cycle will be performed. The dry test conditions were derived from the commercial drying conditions seen in the High Burnup Demonstration and the vacuum drying conditions chosen for a smaller scale Dashpot Drying Apparatus tested at Sandia National Laboratories in FY22. For a given uniform power and pressure/vacuum level, the ADCS was operated at constant power and pressure and allowed to reach steady state conditions. The thermal data obtained from these tests were analyzed, and the results can inform computational models built to simulate commercial drying processes by providing baseline thermal data prior to the introduction of water. Following the preliminary dry tests, a test plan for the ADCS will be developed to implement a drying procedure that begins with the introduction of water to the system and is based on measurements from the drying process used for the High Burnup Demonstration Project. While applying power to the simulated fuel rods, this procedure is expected to consist of filling the ADCS vessel with water, draining the water with applied pressure and multiple helium blowdowns, evacuating additional water with a vacuum drying sequence at successively lower pressures, and backfilling the vessel with helium. Additional investigations are expected to feature failed fuel rod simulators with engineered cladding defects and guide tubes with obstructed dashpots to challenge the drying system with multiple water retention sites. The data from these investigations is expected to inform the efficacy of commercial drying operations through the quantification of residual water in a prototypic-length dry storage canister.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2023

Small Scale Creep Testing of 14YWT via In-situ Transmission Electron Microscopy Irradiation and Nanoindentation

The next generation of nuclear materials must withstand harsh operating conditions such as high temperatures and irradiation doses. Nanostructured ferritic alloys like oxide dispersion strengthened steels, especially 14YWT, have shown promise as a structural material to withstand these harsh operating conditions. For application, understanding the irradiation enhanced creep of the structural components is fundamental to evaluating the service life in a reactor. Challenges with evaluating irradiation enhanced creep are related to the limited space in nuclear reactors and the expense of conducting post irradiation experiments on irradiated cladding. Ion irradiations are considered to expedite irradiation testing, but such experiments have restricted depth of penetration into the material, limiting the ability to characterize changes to material properties after irradiation. Small scale mechanical testing can be used with ion beam irradiations as a potential avenue to evaluate the irradiation enhanced creep of materials. In this study, in-situ transmission electron microscopy nanopillar creep studies on 14YWT were performed and simultaneously ion beam irradiated with 2.8 MeV Au4+ ions. It was observed that the ion beam irradiation did increase the measured strain rate of the materials. In addition, ex-situ nanoindentation creep studies were performed over a range of temperatures on control 14YWT, and it was observed that there was a change in the deformation mechanism between 873 K and 1073 K that agrees well with macro-scale mechanical testing. Furthermore, these results show promise for applying these techniques to nuclear materials in the future.

14 YWT↗
DOE OSTI2023

Evaluation of Thermal Neutron Scattering Cross Section of Uranium Silicide with Ab Initio Lattice Dynamics

Uranium silicide (U 3 Si 2 ) is a candidate material for the high-density nuclear fuel in commercial light water reactors [1], [2]. Its higher uranium density, 11.3 g-U/cm3, compared to that of uranium dioxide (UO 2 ), 9.7 g-U/cm3, can improve the performance of a nuclear reactor while using low enriched uranium (LEU) and diversify the choice of cladding materials [1]–[3]. It also has a higher thermal conductivity than UO 2 , which can reduce the thermal stress on the material caused by a temperature gradient across the fuel pellet and provide a larger margin for some postulated accidents [1], [2], [4]. Furthermore, compared to U3Si, another high-density fuel candidate, it has better resistance to in-pile swelling due to less irradiation-induced rapid amorphization [1], [3]. Corresponding to its importance in nuclear engineering, many previous studies have reported the properties of U3Si2. Experiments showed that U 3 Si 2 is a paramagnetic (PM) metal, where a slight linear increase in magnetic susceptibility was measured with increasing temperature [5], [6]. In addition, thermodynamic quantities such as thermal expansion coefficient, heat capacity, and thermal conductivity were experimentally determined over a wide temperature range [1], [7], [8]. In several computational studies, ab initio atomistic simulations based on density functional theory (DFT) were performed to calculate various properties including elastic constants, electronic density of states (DOS), and phonon dispersion curves [9]–[12]. Nevertheless, thermal neutron scattering cross sections, which are critical to the prediction of the parameters in reactor physics that are ultimately related to reactor criticality, have not yet been evaluated for U3Si2. The scattering cross section can be calculated from the phonon DOS, or the energy spectrum of lattice vibrations, of the crystalline system [13], [14]. However, there is also no experimental data available for the phonon DOS of U 3 Si 2 . While some computational studies reported the phonon DOS and/or dispersion curves from ab initio simulations [9]–[12], the accuracy cannot be guaranteed because it is unclear whether the spin-polarization behavior of PM U 3 Si 2 was properly described. In the present study, the thermal neutron scattering cross section for U 3 Si 2 is evaluated for the first time by calculating the phonon DOS for U3Si2 from ab initio lattice dynamics (AILD) simulations based on DFT. First, U 3 Si 2 is modeled based on the experimental structure, and AILD simulations are performed on the modeled U3Si2 to optimize the structure. Next, AILD simulations are performed for supercells with atomic displacement to calculate Hellmann-Feynman forces. Based on the calculated forces, partial phonon DOSs for U and Si are obtained, and the thermal neutron scattering law (TSL) for U 3 Si 2 is finally evaluated. To verify the accuracy of the calculations in the present study, the calculation results are compared with experimental data on the structure and heat capacity of U3Si2 [1], [7], [8], [15].

Geometry Optimization↗
DOE OSTI2016

Fuel performance analysis of FeCrAl cladding during LWR operation

This work focuses on modeling the integral thermo-mechanical performance of FeCrAl cladded fuel during normal operation in light-water reactors. Preliminary analysis has been performed to assess FeCrAl alloys (namely Alkrothal 720 and APMT) as a suitable fuel cladding replacement for Zr-alloys, using the MOOSE-based, finite-element fuel performance code BISON. These simulations identify the effects of the mechanical-stress and irradiation responses of FeCrAl and provide a comparison with Zr-alloys. In comparing these clad materials, fuel rods have been simulated for normal reactor operation and simple steady-state operation. Normal reactor operating conditions target the cladding performance over the rod lifetime (∼4 cycles) for the highest-power rod in the highest-power fuel assembly under reactor power maneuvering. The power histories and axial temperature profiles input into BISON were generated from a neutronics study on full-core reactivity equivalence for FeCrAl using the 3D full core simulator NESTLE. Evolution of the FeCrAl cladding behavior over time is evaluated by using steady-state operating conditions such as a simple axial power profile, a constant cladding surface temperature, and a constant fuel power history. The fuel rod designs and operating conditions used are based off the Peach Bottom BWR and design consideration was given to minimize the neutronic penalty of the FeCrAl cladding by changing fuel enrichment and cladding thickness. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗