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At least 397 records · Page 22
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

Waste Management Processing Projects in the PRC - 16551

EnergySolutions continues to provide waste treatment solutions in the Peoples Republic of China (PRC). In 2015 ES had completed installation of systems at two different Nuclear power sites (Haiyang, an AP-1000{sup TM} site and Yangjiang, a CPR1000 site). This paper discusses progress on these two projects, and provides new information regarding the operation of the systems. The Yangjiang project became operational in the fall of 2015 while the Haiyang project will be done is nearly done with commissioning and is waiting for reactor operations. Haiyang Project: In the Shandong Province on China's northeast coast, EnergySolutions, as part of a consortium with China Power Investment (CPI) and Yuanda Environmental Protection Engineering Company (a PRC state-owned company), has designed and constructed the site's Site Rad Waste Treatment Facility (SRTF). The SRTF provides solid waste processing services for up to 8 AP-1000s{sup TM}. The SRTF performs the following functions: 1. Five year storage for HICs containing spent resin and filters from the nuclear power plants' waste liquid systems (WLS); 2. Sorting and Compaction System for solid waste generated from Nuclear Power Plant (NPP) operations. This system implements: a) Real time radiography to screen 200 liter waste drums for prohibited items, b) Pre-compaction, c) High Resolution Gamma Spectrophotometry (HRGS) for waste characterization, d) Supercompaction, e) Solidification of compacted drums inside overpack drums which are filled with 60 MPa compressive strength grout, and f) Automatic drum lidding which crimps the drum lid to the drum body. 3. Laundry services for NPP anti-contamination clothing. 4. At the nuclear islands, EnergySolutions is providing mobile liquid waste processing systems that utilize EnergySolutions Advanced Liquid Processing System ALPS{sup TM}/Advanced Injection Method System AIM{sup TM} processing systems to supplement the NPP's WLS system when radionuclide concentrations exceed release criteria. The spent resins and filters from the nuclear power plants are placed in EnergySolutions supplied HICs, dewatered using EnergySolutions Self Engaging Dewatering System (SEDS{sup TM}), and then placed in EnergySolutions 8-120B Type B cask for the transport of the HIC between the NPP and the SRTF and, ultimately, to a disposal site once it is ready for operations Yangjiang Project: EnergySolutions is providing liquid waste treatment system (TEU) and solid waste treatment system (TES) for Yangjiang units 3 and 4 for the China Nuclear Power Engineering Company (CNPEC). The Yangjiang site is located approximately 300 kilometers west of Hong Kong. The TEU system processes floor drain, chemical drain, and process drain tanks liquids to achieve a release concentration less than 37 Bq/l. The TES system receives spent resin and filters into HIC containers which are dewatered and subsequently transported to the Yangjiang sites QT building where they are stored for a period of up to 5 years or until a disposal site are available. TEU (Liquid waste treatment) consists of the following unit operations: - ALPS{sup TM}/AIM{sup TM} system, which includes two separate 8 vessel water treatment systems that consist of granular activated carbon (GAC), cation, anion ion and mixed bed media ion exchange (IX) columns; and: - A reverse osmosis system for final polishing, - TES (solid waste system), - SEDS (Self Engaging Dewatering System), - Shielding for the loading and storage of HICs, - Shielded transport container for the transfer of HIC to the QT building for storage, - Shielded transfer bell for the transport of spent filters from the NPP operating area to HIC. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2016

Innovative Waste Packaging and Associated Venting/Hydrogen Management - 16594

The original strategy for managing intermediate level waste (ILW) was developed in the 1980s by the UK Nuclear Industry Radioactive Waste Executive (NIREX), which is now the Radioactive Waste Management Limited (RWM), a wholly owned subsidiary of the Nuclear Decommissioning Authority (NDA). The strategy involved retrieving ILW, sorting and encapsulating it in cement based grout within thin walled stainless steel containers. The containers would then be transferred to a large purpose-built shielded ILW store on site, where they would be stored until the planned final deep geological disposal facility becomes available. In recognition of the high up-front costs of such a strategy, which requires remote facilities for the encapsulation and storage, and coupled with the long programme duration for the design, construction and commissioning of these facilities, waste management organisations responsible for managing the clean-up of legacy facilities within the UK have, in recent years, sought innovative solutions which could potentially both accelerate clean-up and hazard reduction on sites, and with a lower overall programme lifecycle cost. Many of the recent innovative solutions are focused around a new family of packaging designs known as robust shielded containers (RSCs). These are self-shielded containers manufactured from materials such as ductile cast iron or fabricated steel. These containers offer the potential to package wastes for disposal without encapsulation and avoid the need for a highly engineered remote handled shielded store for interim storage. The paper provides a high level overview of the generic concepts of RSCs developed by Croft and focuses on the specific challenges of wasteform evolution on waste package integrity and performance. In particular, the integrity and performance of the filtered vent system required to manage internal pressurisation and to ensure sufficient venting capacity of hydrogen and other evolved gases. The paper summarises the analysis by ARUP undertaken to substantiate the RSC integrity under detonation/deflagration explosion loadings arising from hydrogen accumulation. Analyses of the structural response of the filter assembly were undertaken for both detonation and deflagration explosion scenarios, with the loadings applied to the filter housing rim and to the filter vent cover. The paper also presents evidence of the mechanical performance of the filter medium in terms of pressure transients during deflagration events and the degree to which filtration efficiency is maintained. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2016

Evaluation of Computed Tomography Techniques for Material Identification in Low Level and Intermediate Level Waste - 16648

Measures required to assure long term safe storage of Low-level and intermediate-level short-lived (LIL/SL) waste generated by the nuclear-power industry in France include the characterization of the waste and identification of materials within the waste. Digital Radiography (DR) techniques using x-ray at energies in the 6 MeV range have been shown to be effective for validation of the integrity of the concrete containers, and it was considered that the use of this technique together with the addition of Computed Tomography (CT) techniques could effectively identify materials within the waste. This paper describes the initial evaluation of two DR imaging techniques and two CT techniques using x-ray energy spectra up to 9 MeV to inspect a surrogate waste package, which comprised an outer concrete cylindrical container of 1400 mm diameter with 148 mm wall thickness, and an overall volume of 2 meters cubed, within which a 200 liter drum containing representative heterogeneous inactive waste, was placed in the center and the annulus between the 200 liter drum and the outer cylindrical package was filled with cement grout. The surrogate waste within the 200 liter drum comprised three separate layers of high density, medium density and low density mixed materials. The equipment used was a linear accelerator producing high energy spectra at either 6 MeV or 9 MeV and a high-precision CT manipulator with X, Y, Z and rotation motions, which were common to all techniques investigated. Two different digital detectors were used in the DR and CT performance evaluations, a Digital Detector Array (DDA) comprising a columnar Thallium-doped Cesium-Iodide scintillator screen in intimate contact with a 2 k by 2 k array of amorphous silicon detectors, 200 μm x 200 μm in area, and a Linear Diode Array (LDA) comprising a line of Cadmium-Tungstate columns, 1 cm thick and 400 μm x 400 μm in area. The work comprised evaluations of linear accelerator spectra and the attenuation effects of the waste container and contents, image acquisition performance of each detector, and CT techniques using area detector and linear detector. The results presented in this paper include mathematical evaluation of the two CT techniques, and analysis of measurement data, digital images, CT reconstruction images, and estimated material densities. The data was compared with recorded details and photographs of the actual configuration of materials within the surrogate waste. The Digital Detector Array can generate CT inspection volumes with considerable resolution and detail for the low-density and medium-density sections of the surrogate waste, however, the high-density sections were not imaged with sufficient detail and the images contained a large number of artifacts mainly due to the detectors lack of high energy photon stopping power. Materials identification with the Digital Detector Array, while possible for certain materials, for materials in the steel to plastic density range the attenuation values of the voxels in the reconstruction are too similar and difficult to resolve from the artifacts present. The Linear Diode Array can generate CT inspection volumes of regions of interest of the low-density and medium-density sections with considerable resolution and contrast, and potentially acceptable levels of resolution and contrast of the high-density section of the waste. While a few artifacts were present in the reconstructions, the majority are not due to the fundamental properties of the detector and are considered to be correctable. Materials identification with the LDA inspection data appear to be viable, with steel, copper, and higher-density metals being readily be distinguished from other materials on the basis of voxel value. Future work is needed to obtain a better definition of optimum spatial resolution and inspection speed, and to develop a system of 'calibration rods' which would consist of a series of 50 mm diameter cylinders of 7 materials; Plastic, Teflon, Concrete, Aluminum, Copper, Tungsten and Lead. The cylinders will be distributed at a certain radius in the surrogate waste and will be used as reference points in the evaluation and demonstration of the contrastive performance for the low, medium and high-density cases. The ability to identify the materials within a sealed waste container, by nondestructive examination, enables the verification of waste acceptance criteria without the need to open the waste containers. This eliminates the need for complex and expensive equipment to open and remotely handle the intermediate level waste, avoids potential hazards and risk of personnel dose uptake, and does not increase the volume of waste caused by repackaging of materials after examination and the decontamination or disposal of equipment used.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2018

Cementation of Nuclear Wastes: From Past to Future in a Sustainable Approach - 18266

Cementation of nuclear wastes is a widespread technology due to several factors such as excellent feedback from past experience, simplicity of implementation and versatility. Indeed, as nuclear wastes come in many physical states (bulk wastes, powders, sludges), cementation is the immobilisation process that can easily accommodate this large range of wastes provided the appropriate mixing technology is used: heterogenous cementation (grouting of bulky wastes) or homogenous cementation (intermixing process between the powder or the sludge and the cementitious material). However, nuclear wastes equally present an important chemical variability. This is especially true as New Areva's range of nuclear activities covers the entire fuel cycle: mining, conversion, enrichment and recycling and dismantling and decommissioning. The chemical interactions between the waste and the cement matrix are carefully studied by New Areva's R and D teams in order to provide comprehensive solutions by developing cement formulations which are adapted to wastes characteristics. The aim of the studies is to obtain cement waste-forms that meet the waste acceptance criteria, the final product being thus in perfect adequacy with the disposal requirements. For over 30 years New Areva has been developing cement formulations adapted to the physical and chemical specificities of the wastes accounting for constrains imposed by waste characteristics. The overall approach includes the definition of the appropriate cement composition at laboratory scale, engineering design, equipment manufacturing, testing and commissioning of the cementation facilities. With this strong technical background, a specific methodology has been developed by New Areva teams in order to allow a rapid screening of possible solutions for a given waste (in terms of cement chemistry adapted to the waste) in a learn-fast approach that is based on theoretical analysis and small-scale tests. The methodology was applied for wastes presenting a complex nature (such as reactive metals, ion exchange resins, oils and solvents, mercury, etc), known to interact with Portland cement from a chemical point of view and leading to durability issues of the wasteform (swelling, strength reduction, leaching) and thus reducing the final waste loading. Once the screening process is over, the main drivers for choosing the most appropriate solution to be further developed at pilot scale are: reducing the overall volume and the impact of the final waste package, ensure the waste package performance as defined by the disposal requirements and control the long-term behaviour in final disposal. Moreover, a modelling approach is addressed, aiming to develop a thermo-chemo-mechanical (THM) concrete models that are able to predict the behaviour of the structure (waste form) in time. The aim of the present paper is to describe the main principles within the developed methodology and illustrate it by using a few specific examples. Several distinct cement formulations are developed for complex wastes, limiting the chemical interaction between the cement matrix and the given wastes, obtaining better waste loadings and better overall durability behaviour which facilitates long term behaviour demonstration. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2018

Use of Robotics in Liquid Waste System - {sup 3}H Evaporator, Tank Closure and Defense Waste Processing Facility - 18525

The Savannah River Site (SRS) Liquid Waste System (LWS) safely stores and treats high-level radioactive waste. The LWS consists of 51 waste storage tanks (eight of which are operationally closed and filled with grout), waste evaporators, treatment facilities, and solidification facilities such as the Defense Waste Processing Facility (DWPF) and Salt-stone Production Facility (SPF). At Savannah River Remediation (SRR), the liquid waste contractor, robotic technologies are needed to enter areas and spaces that are otherwise inaccessible or prohibit direct access by workers due to unsafe, unstable, or unknown physical or structural conditions; or configurations that are hard to reach or beyond reach without taking extraordinary mechanical measures. As discussed below, SRR uses robotic technologies at various LWS facilities to reduce dose to the workers as well as provide access to unreachable locations due to the presence of radiological or chemical hazards. (author)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2020

Special Analyses for the Hanford Integrated Disposal Facility Performance Assessment - 20102

In 2014, the Department of Energy (DOE) Office of River Protection and its contractors began to develop a performance assessment for the near-surface disposal of low-level and mixed low-level waste at the Hanford Site's Integrated Disposal Facility (IDF). The IDF is a doubly-lined landfill that was constructed between 2004 and 2006 to be the disposal facility for the vitrified low-activity waste that will be produced at the Waste Treatment and Immobilization Plant (WTP). IDF is also expected to receive solid secondary waste produced at the WTP and other solid wastes from site activities. The IDF has been in a preoperational state awaiting authorization from DOE and a RCRA permit modification from the State of Washington Department of Ecology to receive waste. Both the Disposal Authorization Statement and permit modification require a performance assessment demonstrating that the system of engineered and natural features will limit releases of radionuclides and hazardous chemicals from the IDF and be protective of human health and the environment. The simulated duration is 10,000 years. Based on the analyses presented in the 2017 Integrated Disposal Facility Performance Assessment, DOE issued a conditional Operating Disposal Authorization Statement for the IDF in June 2018. The long-term performance of the IDF to be protective of human health and the environment was evaluated under the requirements of DOE Order 435.1, Radioactive Waste Management. Computer simulations were performed to evaluate whether or not the IDF would comply with DOE requirements. In the time that has passed since the performance assessment was approved by DOE, new information has been discovered that had not been considered in the performance assessment. Since this new information has not been evaluated, the potential impact of the changes have not been taken into consideration in DoE's disposal authorization. DOE and its contractors follow a change control process to screen and, when necessary, evaluate new information that could potentially impact the conclusions of the completed performance assessment. This paper will describe the change control process and provide two examples of evaluations performed following the change control process. The first example evaluates a new waste form for liquid secondary waste that was not evaluated in the performance assessment. In the performance assessment, liquid secondary waste was assumed to be solidified with grout. A new recommendation to dispose of the liquid secondary waste after drying it to a powder was evaluated. The second example evaluates inventory implications from changes to the flow sheet that estimates the feed composition to the low-activity waste vitrification facility. The changes result in higher strontium concentrations in the vitrified waste stream. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2020

Utilizing Commercial Submersible Mixer Pumps for Sludge Removal in Savannah River Site's Tank 26 - 20289

The Savannah River Site (SRS) Liquid Waste System (LWS) safely manages, stores, treats, and dispositions liquid radioactive waste. The LWS consists of 51 underground waste storage tanks (eight of which are operationally closed and filled with grout), waste evaporators, treatment facilities, and solidification facilities, known as the Defense Waste Processing Facility (DWPF) and Saltstone Production Facility (SPF). One of the waste storage tanks, Tank 26, was placed into service in 1980 as an F Tank Farm (FTF) Evaporator Feed Tank. From 1980 to 2013, Tank 26 received F Canyon receipts and dilute supernate that was then transferred to the 242-16F FTF Evaporator for volume reduction. In 2013, the steam tube bundle failed in the FTF Evaporator, and the decision was made not to repair/resume evaporator operation. During operation of Tank 26, solids built up to a level of 2.03 m in the tank with a volume of 1062.9 kL. Due to the evaporator failure and subsequent shutdown, the solids in Tank 26 were selected to feed Sludge Batch 10, which is collected and prepped prior to being sent to DWPF for final disposition. To accomplish solids removal, Commercial Submersible Mixer Pumps (CSMPs) were selected to slurry the solids in preparation to be sent to Tank 51. Four CSMPs were installed in Tank 26 with each one installed in a separate quadrant of Tank 26. This work would mark the first deployment of CSMPs in an SRS waste tank. The CSMPs were developed in response to operational issues from previous mixing pumps and budgetary constraints. The CSMPs use the concept of modifying commercially available equipment for nuclear waste applications. The CSMPs consist of a 230-horsepower submersible mixing pump (manufactured by GPM, Inc.) joined to a mast fabricated at SRS. For this application, Savannah River Remediation (SRR) design services was challenged to provide a mast design that required no steel superstructure support system on top of Tank 26. Also, SRR design services provided a simplified Tank 26 riser interface that did not require extensive machine parts to adjust height of the suction screen of the CSMP within the tank. Other design improvements include no requirements for tank top radiation monitors and no requirements for flushing of the CSMPs during startup/shutdown operations. The CSMPs were operated at an initial height of 2.29 m above the Tank 26 bottom for 10 days. After sludge sounding, the CSMPs were lowered to a height of 1.52 m with no issues due to proper work planning and the simplified riser interface. With the CSMPs lowered to a level of 1.52 meters above the tank bottom, the CSMPs were operated for 12 days and another sounding was performed. The sounding level came back matching the disturbance depth results of the first pump run. Chemistry samples were analyzed while the tank was left to settle. The analysis revealed enough weight percent solids to provide good feed to Sludge Batch 10. Also, the results revealed the supernate within the mixture would provide good salt solution feed to Salt Waste Processing Facility (SWPF) Salt Batch 3. So, the plan was modified to let the disturbed solids settle and decant the salt solution for addition to SWPF Salt Batch 3. Then water will be added back to Tank 26, and the CSMPs run in order to wash the solids to decrease settling time prior to being sent to Tank 51 for Sludge Batch 10. Utilizing CSMPs for waste removal in an SRS Tank has provided a cost-effective means for further waste removal efforts. In addition, the CSMPs are easier to operate by utilizing a robust and simplified design. The CSMPs performed quite well with no process shutdown or delays during operation. As a result, CSMPs are integral to the future of removing radioactive waste from storage tanks at SRS. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2024

Application of Process Chemical Modeling to Optimize Radioactive Waste Disposal at the Savannah River Site – 24242

The Liquid Waste Program (LWP) managed by Savannah River Mission Completion (SRMC) is responsible for the treatment and disposal of waste at the Savannah River Site (SRS). Radioactive waste at SRS is stored and processed at four key facilities – each with their respective functions to store, blend, grout, or vitrify waste. The tank farm, where waste is stored, consists primarily of legacy waste with new material incoming from the Accelerated Basin De-inventory program (ABD), which is managed by Savannah River Nuclear Solutions (SRNS). System planning is done by SRNS and SRMC to optimize ABD and LWP operations, respectively.

Georgiou, Andreas↗
DOE OSTI2026

Improving Elemental Mercury Recovery in DWPF by pH and Ionic Strength Studies Using Laboratory Scale Replica – 26141

In order to safely disposition nuclear material at large scales, the Savannah River Site (SRS) constructed the Salt Waste Processing Facility (SWPF) for the removal of actinides, the Saltstone facility for preparation of a low-level cementitious grout, and the Defense Waste Processing Facility (DWPF) for the vitrification of high-level waste (HLW). A few years after processing began, high concentrations of mercury were discovered in cementitious waste at the Saltstone facility which initiated a search for the source of mercury during processing at these SRS facilities. Mercury serves as a catalyst in the dissolution of spent nuclear fuel, aluminum-actinide alloys, for actinide recovery, but not enough is known about the behavior and properties of mercury within these process streams.

Pina, Jeanette [Savannah River National Laboratory↗
DOE OSTI2026

Tank 11H Low Temperature Aluminum Dissolution and Inhalation Dose Potential Analyses at Savannah River Site – 26018

Currently, there is approximately 34 million gallons of high-level radioactive tank waste in the Tank Farm at the Savannah River Site (SRS). The ultimate goal of operations at the Tank Farm is to remove the high level waste (HLW) from the tanks followed by stabilization of the waste through vitrification of the HLW into glass or grouting the decontaminated waste into saltstone. After bulk removal of the HLW consisting of sludge, saltcake, and supernatant, further efforts are made to reduce the residual waste present in the tank in order to declare preliminary cease waste removal (PCWR) signifying completion of HLW removal. These reduction efforts can include tank washing to remove soluble salts and radioisotopes and dissolution of solids including aluminum. Aluminum in the form of gibbsite and boehmite is relatively insoluble in water. Through addition of aqueous sodium hydroxide, the aluminum can be dissolved at mild temperatures. In order for the waste tank to meet closure mode requirements of the Concentration, Storage, and Transfer Facilities (CSTF), which includes the Tank Farm, Documented Safety Analysis (DSA), a component of the safety basis, the inhalation dose potential (IDP) and the radiolytic hydrogen generation rate of the stored waste must be demonstrated to be lower than their respective designated limits. These parameters are calculated from measured radiochemical analyses of isotopes that emit a high amount of radioactivity including Cs-137, Sr-90, Pu-238, Pu-239, Pu-240, Pu-241, Am-241, and Cm-244. Following the low temperature aluminum dissolution (LTAD) process, Tank 11H slurry samples were pulled from the tank and sent to Savannah River National Laboratory (SRNL) to measure the extent of aluminum dissolution, hydroxide concentration, densities of slurry and supernatant, weight percent solids analyses, and radionuclide activities. The analyses of the composite sample found that approximately 90% of the total aluminum in the slurry was dissolved, indicating successful reduction of the insoluble aluminum in the waste tank. Additionally, the weight percent insoluble solids (slurry basis) measurement of the composite sample was found to be approximately 1%, demonstrating that minimal solids still remain in the tank. Finally, the radiochemical analyses of the composite sample determined that the waste contents of the tank met the IDP and radiolytic hydrogen generation rate requirements of the CSTF DSA. These measurements have shown that the LTAD process in Tank 11H was successful in waste reduction efforts and a positive step towards declaring PCWR and tank closure at SRS.

Dekarske, John [Savannah River National Laboratory↗
DOE OSTI2026

Update on Integrity Monitoring, Prediction and Assessment, Corrosion Control, and Repair of the Hanford Storage Tanks

DOE has launched a multi-year research program with the focus of preserving and increasing available volume for waste storage at Hanford. The long-term availability and operability of the Hanford Double Shell Tanks (DST) is critical to the completion of the Hanford mission. Maintaining the integrity of the tank will involve having a technology for repair or refurbishment of a DST should the tank function be compromised by degradation, monitoring the tank for indications of accelerated degradation, developing a means for mitigating accelerated degradation, and evaluating options for increasing the storage capacity in the tank farm without constructing new tanks. The project work was started in the middle of 2024; significant progress has been made in the following four areas: (i) tank refurbishment using a high performance grout and an epoxy sealant layer system, (ii) developing a chemically and radiologically stable reference electrode, (iii) designing and implementing a cathodic protection system to mitigate underside corrosion of DST secondary shells, and (iv) exploring evaporation to increase waste storage capacity.

Shukla, Pavan [Savannah River National Laboratory ↗
DOE OSTI2014

Fast Multiresolution Reads of Massive Simulation Datasets

Today’s massively parallel simulation codes can produce output ranging up to many terabytes of data. Utilizing this data to support scientific inquiry requires analysis and visualization, yet the sheer size of the data makes it cumbersome or impossible to read without computational resources similar to the original simulation. We identify two broad classes of problems for reading data and present effective solutions for both. The first class of data reads depends on user requirements and available resources. Tasks such as visualization and user-guided analysis may be accomplished using only a subset of variables with a restricted spatial extent at a reduced resolution. The other class of reads requires full resolution multivariate data to be loaded, for example to restart a simulation. We show that utilizing the hierarchical multiresolution IDX data format enables scalable and efficient serial and parallel read access on a variety of hardware from supercomputers down to portable devices. Here, we demonstrate interactive view-dependent visualization and analysis of massive scientific datasets using low-power commodity hardware, and we compare read performance with other parallel file formats for both full and partial resolution data.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2019

A Bayesian approach to calibrating hydrogen flame kinetics using many experiments and parameters

First-principles Markov Chain Monte Carlo sampling is used to investigate uncertainty quantification and uncertainty propagation in parameters describing hydrogen kinetics. Specifically, we sample the posterior distribution for thirty-one parameters focusing on the H 2 O 2 and HO 2 reactions resulting from conditioning on ninety-one experiments. Established literature values are used for the remaining parameters in the mechanism as well as other thermodynamic and transport data needed to specify fluid properties. The samples are computed using an affine invariant sampler starting with broad, noninformative priors. Autocorrelation analysis shows that O(1M) samples are sufficient to obtain a reasonable sampling of the posterior. The resulting distribution identifies strong positive and negative correlations and several non-Gaussian characteristics. Using samples drawn from the posterior, we investigate the impact of parameter uncertainty on the prediction of two more complex flames: a 2D premixed flame kernel and the ignition of a hydrogen jet issuing into a heated chamber. The former represents a combustion regime similar to the target experiments used to calibrate the mechanism and the latter represents a different combustion regime. For the premixed flame, the net amount of product after a given time interval has a standard deviation of less than 2% whereas the standard deviation of the ignition time for the jet is more than 10%. The samples used for these studies are posted online. These results indicate the degree to which parameters consistent with the target experiments constrain predicted behavior in different combustion regimes. Finally, this process provides a framework for both identifying reactions for further study from candidate mechanisms as well as combining uncertainty quantification and propagation to, ultimately, tie uncertainty in laboratory flame experiments to uncertainty in end-use numerical predictions of more complicated scenarios.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2015

Accelerated application development: The ORNL Titan experience

The use of computational accelerators such as NVIDIA GPUs and Intel Xeon Phi processors is now widespread in the high performance computing community, with many applications delivering impressive performance gains. However, programming these systems for high performance, performance portability and software maintainability has been a challenge. In this paper we discuss experiences porting applications to the Titan system. Titan, which began planning in 2009 and was deployed for general use in 2013, was the first multi-petaflop system based on accelerator hardware. To ready applications for accelerated computing, a preparedness effort was undertaken prior to delivery of Titan. In this paper we report experiences and lessons learned from this process and describe how users are currently making use of computational accelerators on Titan.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2022

A Moving Embedded Boundary Approach for the Compressible Navier-Stokes Equations in a Block-Structured Adaptive Refinement Framework

A computational technique has been developed to perform compressible flow simulations involving moving boundaries using an embedded boundary approach within the block-structured adaptive mesh refinement (SAMR) framework of AMReX [1], [91], [92]. We leverage the SAMR capability to obtain quantitatively accurate results whilst using robust, second-order finite volume schemes. A conservative, unsplit, cut-cell approach is utilized and a ghost-cell approach is developed for computing the flux on the moving, embedded boundary faces. A third-order least-squares formulation has been developed to compute the wall velocity gradients, and was found to significantly improve the performance of the solver in terms of the quantitative comparison of surface quantities such as the skin friction coefficient. Various test cases are performed to validate the method, and compared with analytical, experimental, and other numerical results in literature. Inviscid and viscous test cases are performed that span a wide regime of flow speeds - acoustic (harmonically pulsating sphere), smooth flows (expansion fan created by a receding piston) and flows with shocks (shock-cylinder interaction, shock-wedge interaction, pitching NACA 0012 airfoil and shock-cone interaction). A closed system with moving boundaries - an oscillating piston in a cylinder, showed that the percentage error in mass within the system decreases with refinement, demonstrating that the numerical scheme is conservative with grid refinement, but is not discretely conservative. Viscous test cases involve that of a horizontally moving cylinder at Re = 40, an inline oscillating cylinder at Re = 100, and a transversely oscillating cylinder at Re = 185. The judicious use of adaptive mesh refinement with appropriate refinement criteria to capture the regions of interest leads to well-resolved flow features, and good quantitative comparison is observed with the results available in literature.

adaptive refinement↗