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At least 397 records · Page 22

Accelerating Hanford Site Cleanup through Operations Research Modeling - 20238

The Hanford Site cleanup effort will require the integration of dozens of unique facilities and processes, many of which will be first-of-a-kind in implementation and design. Each facility will be governed by its own set of operating logic, configured with a unique array of unit operations, and subject to a set of constraints that will affect its behavior. The collection of facilities have multiple points of interface, making the operations of any one facility potentially significant to the operations of other up- or downstream processes. It is therefore highly desirable to accurately predict these operations, as it allows for Site officials to identify and preempt bottlenecks and vulnerabilities before they unexpectedly inhibit the cleanup mission. With the quantity and complexity of the processes that will be on Site, building a pen-and-paper or even a spreadsheet-assisted model of the cleanup mission quickly becomes overwhelming in scope and inaccurate in execution. The Engineering organization for the Site's Tank Operations Contract (TOC) has therefore implemented the use of operations research (OR) modeling to simulate and predict future operations of Site facilities. These models are created using a discrete event simulation tool that allows for the development of detailed, versatile, and robust models. Not only can these models account for complex logical behaviors, but they can also simulate process details down to the level of vessel sizing, labor utilization, equipment reliability, and resource availability. To date, the TOC has developed OR models for several facilities on Site, including for single-shell tank (SST) farms, double-shell tank (DST) farms, the Effluent Treatment Facility (ETF), and the waste transfer system. These models have focused on identifying bottlenecks and operational constraints, and have been used to quantify the effects of implementing process changes. This latter point is particularly valuable, as it allows for several alternatives to be studied in a virtual setting before committing resources to making a change in the field. The decision to develop OR models has gained tremendous support from the Site's stakeholders and the U.S. Department of Energy (DOE) management, and has prompted the use of the tool to support additional internal and external initiatives. Recently, an initiative was proposed to use the models to help identify and provide quantitative backing for risks and opportunities for the TOC. This application of OR could not only help inform how the TOC manages its risks (e.g. quantities and types of spare parts), but could also help drive process improvements whose benefits might otherwise be hard to quantify. The models have also been used to drive the TOC's cloud computing, artificial intelligence (AI), and machine learning (ML) initiatives. These initiatives will not only improve the ability of the TOC to more rapidly respond to the needs of its customers, but it will also aid in the ability of the TOC to analyze and improve the processes it studies. Partnership with two external software development and consulting companies (Lanner and Ynformed) has furthered not only the application of AI and ML within the TOC, but has also spurred the development of new/improved software tools and platforms used by the companies. These partnerships have proven to be mutually beneficial and productive, and have set a precedent for the types of gains that can be made by exploring such options. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Argonne Reactor Code Software Verification and Validation Plan for the Versatile Test Reactor

This Argonne Reactor Code (ARC) software has taken a pivotal role in the design work of the Versatile Test Reactor. The ARC software itself consists of several independent or semiindependent pieces of software that are used in concert to carry out specific analysis and design objectives. In this report, we discuss the validation that is needed for the ARC software overall and discuss available, usable experimental data and how it relates to the VTR project. We also discuss the verification that is required for the ARC software with respect to its usage in the VTR project and give some concrete examples as to what it must accomplish. A list of goals for the verification and validation work are presented as the general procedure that will be implemented for every individual piece of software in ARC. The ARC software has been continuously developed for over 50 years and many of the features used for the VTR project have thus been rigorously tested for accuracy during that timeframe. The ARC software is presently under source code control and undergoes nightly regression testing of not only the individual pieces, but the interconnected aspects that are common to most analysis projects. Its greatest weakness, from a software verification and validation perspective, is both a lack of documentation and outdated documentation. As an example, much of the previous validation work will require contemporary effort to re-evaluate given the updated base data libraries and modifications to the software that have occurred since. This requires new documentation to be produced to support the usage of the software in the VTR project. The bulk of the ARC software is focused on steady state neutronics and TH behavior of a reactor system. In this regard, we have identified the ZPPR, FFTF, and EBR-II programs as the best candidates for sources of validation data for the VTR project. The ZPPR-15 series in the ZPPR program was chosen as it is the best representation of the VTR fuel form and reactor core layout of all of the ZPPR measurements. Additional support for it comes from the fact that most of the data has already been processed into usable ARC models for VTR validation. The FFTF and EBR-II reactors were both functional reactors that provide reactor scale measurements. FFTF is clearly a closer match to VTR and its startup measurements would be a very valuable validation basis. EBR-II has invaluable burnup related measurements that will play a key role in the ARC software validation work. Each piece of ARC software will require a report detailing the software verification. The validation work will be logically split into the results of modeling each identified experimental resource (ZPPR, EBR-II, FFTF). The intended timeline for the VTR project is to have the ARC software verified and validated by the end of fiscal year 2020. This is incumbent on sufficient funding allocated to V&V activities and no change in programmatic priorities.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Experimental Investigation on Metallic Droplet Behavior in Molten BOF Slag

In order to better understand the metallic droplet behavior during a slag treatment process, a physical modeling based on the similarity principle was performed in a transparent scaled-down vessel at room temperature. Paraffin oil, 20 wt pct copper sulfate solution, and compressed air were used to simulate the molten slag, metallic droplet, and carrier gas, respectively. The droplets injected into paraffin oil during the experiment were captured by a high speed camera and were analyzed by Image Pro Plus software to obtain the droplet size distribution. The critical droplet size in the physical modeling and slag treatment process is quantitatively correlated. The results show that droplet breakage phenomenon is dominant over its coalescence in the current industrial practice, and droplet breakage is enhanced with increasing gas flow rate and/or lance depth. No significant effect of the nozzle configuration was found on the droplet breakage and coalescence. The droplet size distribution varies with the lance position. Gas flow rate and lance depth are the most important factors for droplet breakage, the extent of which can be reduced through a proper selection of the operational conditions. A linear relationship between the droplet size and the input energy flux is obtained.

36 MATERIALS SCIENCE↗

SU-C-210-07: Assessment of Intra-/Inter-Fractional Internal Tumor and Organ Movement in Radiotherapy of Head and Neck Cancer Using On-Board Cine MRI

Purpose: Head and neck (H&N) internal organ motion has previously been determined with low frequency and temporary nature based on population-based pre- and post-treatment studies. Using immobilization masks and adding a 4–6 mm planning-tumor-volume margin, geometric uncertainties of patients are routinely considered clinically inconsequential in H&N radiotherapy. Using the first commercially-available MR-IGRT system, we conducted the first quantitative study on inter-patient, intra- and inter-fractional H&N internal motion patterns to evaluate the necessity of individualized asymmetric internal margins. Methods: Ninety cine sagittal MR image sequences were acquired during the entire treatment course (6–7 weeks) of three H&N cancer patients using the ViewRay™ MR-IGRT system. The images were 5 mm thick and acquired at 4 frames/per second. One of the patients had a tracheostomy tube. The cross-sectional H&N airway (nasopharynx, oropharynx, and laryngopharynx portions) movement was analyzed comprehensively using in-house developed motion detection software. Results: Large inter-patient variations of swallowing frequency (0–1 times/per fraction), swallowing duration (1–3 seconds), and pharyngeal cross-sectional area (238–2516 mm2) were observed. Extensive pharyngeal motion occurred during swallowing, while nonzero and periodic change of airway geometry was observed in resting. For patient 1 with tracheostomy tube replacement, 30.3%, 30.0%, 48.7% and 0.3% of total frames showed ≥ 4 mm displacements in the anterior, posterior, inferior, and superior airway boundaries, respectively; similarly, (5.7%, 0.0%, 0.0%, 0.3%) and (23.3%, 0.0%, 35.7%, 1.7%) occurred for patients 2 and 3. Area overlapping coefficients with respect to the first frame were 76.3+/−6.4%, 90.3+/−0.6%, and 92.3+/−1.2% for the three patients, respectively. Conclusion: Both the resting and swallowing motions varied in frequency and amplitude among the patients and across fractions of a patient’s treatment. Patients receiving surgery that alters their respiratory and swallowing behavior can have significant intra-fractional internal motion. Patient-specific organ/tumor motion analysis may yield individualized asymmetric internal margins and improve the therapeutic ratio.

60 APPLIED LIFE SCIENCES↗

Insert Modeling in UNF ST&DARDS

The Used Nuclear Fuel-Storage, Transportation & Disposal Analysis Resource and Data System (UNF-ST&DARDS) is a software tool that integrates a used nuclear fuel (UNF) or spent nuclear fuel (SNF) relational database and key analysis capabilities to simplify and automate numerous UNF management and fuel cycle–related activities. UNF-ST&DARDS is being developed for the US Department of Energy’s Office of Nuclear Energy Spent Fuel and Waste Disposition program. UNF-ST&DARDS provides an integrated framework that uses advanced modeling and simulation to predict the behavior of SNF over the timescales associated with permanent disposal in a geologic repository. After leaving the spent fuel pool, SNF is transferred to dry storage in a dual-purpose canister (DPC). DPCs are considered “dual purpose” because they are designed for both storage and transportation, removing the need to transfer the fuel to a separate transportation cask. However, much research has been conducted investigating the feasibility of directly disposing of DPCs in geologic repositories. Direct disposal of DPCs could reduce worker exposure during repackaging, reducing the amount of low-level waste from the discarded DPCs and potentially saving billions of dollars. Therefore, direct disposal of as-loaded DPCs is desirable if it can be done safely.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Research on the Corrosion Behavior of X70 Pipeline Steel Under Coupling Effect of AC + DC and Stress

The coupling effect of stray AC (alternating current) + DC (direct current) and tensile stress-induced X70 pipeline corrosion is complicated with its mechanism uncovered. In this work, the corrosion behavior of X70 pipeline steel under three different corrosion (including an individual AC corrosion, mixed AC + 150 MPa tensile stress corrosion, coupling effect of AC + a 30 A/m{sup 2} DC interference and 150 MPa tensile stress corrosion) conditions in Dagang soil simulated solution was investigated by COMSOL Multiphysics software simulation, electrochemical tests, scanning electron microscope and other techniques. The results indicated that with the increase in AC density, the open-circuit potential of the X70 steel samples was negatively shifted and corrosion rate increased in three different corrosion conditions. The corrosion rates of X70 steel samples under individual AC interference were almost unchanged when 150.9 MPa tensile stress was applied. When applying 30 A/m{sup 2} DC interference, the corrosion rate of X70 steel increases significantly. Therefore, the factors affecting corrosion performance of X70 pipeline steel were DC > AC > stress. Under individual AC interference, uniform corrosion occurred on the X70 steel at an AC current density of less than 30 A/m{sup 2}, while the pitting corrosion occurred at an AC current density of greater than 100 A/m{sup 2}. The application of tensile stress and DC had a certain inhibitory effect on pitting corrosion.

36 MATERIALS SCIENCE↗

Economic Assessment of Nuclear Hybrid Energy Systems: Nuclear-Renewable-Water Integration in Arizona

One of the goals of the Nuclear-Renewable Hybrid Energy Systems (N-R HES) modeling and simulation (M&S) project is to assess the economic viability of N-R HES in a market that contains Variable Renewable Energy (VRE) sources like solar. The N-R HES M&S project is a multi-laboratory effort, led by Idaho National Laboratory (INL) and supported by Argonne National Laboratory (ANL) and Oak Ridge National Laboratory (ORNL). Development of the N-R HES software framework was initiated at INL in 2016 [1] and has reached some level of maturity such that it can be applied to more than simple demonstration cases, e.g. real industry problems. Nevertheless, more capabilities are constantly added to accommodate the special needs of challenging, real-life problems. The N-R HES framework is built on the Risk Analysis Virtual ENvironment (RAVEN) code [2], which it uses as a driver and workflow manager for all calculations. There are four main cornerstones of the N-R HES simulation framework: 1) The generation of stochastic synthetic time series. 2) A set of probabilistic analysis and optimization algorithms available in RAVEN. 3) A set of models for representing the physical behavior of N-R HES. These can be reduced-order models or high-fidelity Modelica [3] models. 4) The RAVEN plug-in called CashFlow [4] that maps physical performance into economic performance. Within this framework, a broad spectrum of questions related to N-R HES can be addressed. One of the challenges currently of high interest is the increasing penetration of VRE altering the profile of the net demand (demand after removing all non-curtailable renewable energy sources, e.g. rooftop solar). The N-R HES software framework is capable of analyzing the potential feasibility of mitigating the resultant volatility in the net electricity demand. One possible solution to manage net demand volatility is adding stabilizing loads to the grid. These loads can be external industrial processes that are able to ramp production up and down quickly, or for regulated markets, adding variable internal loads that will effectively increase the baseload of the power plant and therefore reduce the risk of internal demand that is lower than the capacity of the power plant. The latter is a possible solution currently being considered by Arizona Public Service (APS), the operating owner of the Palo Verde (PV) Nuclear Power Plant (NPP).

97 MATHEMATICS AND COMPUTING↗

A Hardware and Software Co-design Framework for Energy Efficient Neuromorphic Systems

Neuromorphic systems can be realized by a variety of algorithms and architectures. A common understanding is that spiking neuromorphic designs, which encode information into spatio-temporal spiking events, are both a biologically-accurate and efficient way of processing information. However, representing the information through timing relationships induces sophisticated circuit designs in traditional CMOS-based implementations. In recent years, high-capacity resistive memory (RRAM, aka, memristor) has demonstrated great potential in mimicking synaptic behaviors. Several RRAM-based spiking neuromorphic designs exist, most of which focus on rate coding schemes. These designs simplify circuit implementations of neuron models and explore challenges such as unsatisfactory speed, resolution, and performance. As an alternative, we will explore temporal coding spiking neuromorphic systems that encode information as the relative timing of neuron activations (spikes), which have been proven to be more adaptive and energy-efficient. Developing a neuromorphic system for spiking neural network (SNN) inference and online training, however, faces some major technical challenges: (1) It lacks circuit implementation support for temporal-coding SNN to achieve satisfying power efficiency and accuracy; (2) Although existing research works have investigated memristive synapse and neuron designs for spike-timing-dependent plasticity, the non-ideal conditions in implementation, such as device variations and signal degradation, degrade online learning accuracy of large scale systems; and (3) Non-optimized, inter-layer data traffic in SNNs, leads to unnecessary data communication costs. In this project, we plan to address these challenges by a hardware and software co-design framework that incorporates solutions at the circuit, architecture, and algorithm levels. At the circuit-level, we will elaborate on the in-situ SNN processing element designs for supporting both inference and online training modes. Variation-aware schemes will be studied to improve reliability. At the architecture level, we propose a pipelined, asynchronous architecture to retain the timing resolution of spikes. At the algorithm level, we will investigate an innovative SNN training algorithm for enabling activation sparsification and reducing unnecessary data communication costs. This neuromorphic system will provide an effective solution to real-life energy-constrained applications and significantly contribute to the exploration of next-generation high-performance computing systems under the DOE context.

97 MATHEMATICS AND COMPUTING↗

Analysis of the Space Propulsion System Problem Using RAVEN

This paper presents the solution of the space propulsion problem using a PRA code currently under development at Idaho National Laboratory (INL). RAVEN (Reactor Analysis and Virtual control ENviroment) is a multi-purpose Probabilistic Risk Assessment (PRA) software framework that allows dispatching different functionalities. It is designed to derive and actuate the control logic required to simulate the plant control system and operator actions (guided procedures) and to perform both Monte- Carlo sampling of random distributed events and Event Tree based analysis. In order to facilitate the input/output handling, a Graphical User Interface (GUI) and a post-processing data-mining module are available. RAVEN allows also to interface with several numerical codes such as RELAP5 and RELAP-7 and ad-hoc system simulators. For the space propulsion system problem, an ad-hoc simulator has been developed and written in python language and then interfaced to RAVEN. Such simulator fully models both deterministic (e.g., system dynamics and interactions between system components) and stochastic behaviors (i.e., failures of components/systems such as distribution lines and thrusters). Stochastic analysis is performed using random sampling based methodologies (i.e., Monte-Carlo). Such analysis is accomplished to determine both the reliability of the space propulsion system and to propagate the uncertainties associated to a specific set of parameters. As also indicated in the scope of the benchmark problem, the results generated by the stochastic analysis are used to generate risk-informed insights such as conditions under witch different strategy can be followed.

97 MATHEMATICS AND COMPUTING↗

Final Report for CCS Cross-Layer Reliability Visioning Study

The geometric rate of improvement of transistor size and integrated circuit performance known as Moore's Law has been an engine of growth for our economy, enabling new products and services, creating new value and wealth, increasing safety, and removing menial tasks from our daily lives. Affordable, highly integrated components have enabled both life-saving technologies and rich entertainment applications. Anti-lock brakes, insulin monitors, and GPS-enabled emergency response systems save lives. Cell phones, internet appliances, virtual worlds, realistic video games, and mp3 players enrich our lives and connect us together. Over the past 40 years of silicon scaling, the increasing capabilities of inexpensive computation have transformed our society through automation and ubiquitous communications. Looking forward, increasing unpredictability threatens our ability to continue scaling integrated circuits at Moore's Law rates. As the transistors and wires that make up integrated circuits become smaller, they display both greater differences in behavior among devices designed to be identical and greater vulnerability to transient and permanent faults. Conventional design techniques expend energy to tolerate this unpredictability by adding safety margins to a circuit's operating voltage, clock frequency or charge stored per bit. However, the rising energy costs needed to compensate for increasing unpredictability are rapidly becoming unacceptable in today's environment where power consumption is often the limiting factor on integrated circuit performance and energy efficiency is a national concern. Reliability and energy consumption are both reaching key inflection points that, together, threaten to reduce or end the benefits of feature size reduction. To continue beneficial scaling, we must use a cross-layer, Jull-system-design approach to reliability. Unlike current systems, which charge every device a substantial energy tax in order to guarantee correct operation in spite of rare events, such as one high-threshold transistor in a billion or one erroneous gate evaluation in an hour of computation, cross-layer reliability schemes make reliability management a cooperative effort across the system stack, sharing information across layers so that they only expend energy on reliability when an error actually occurs. Figure 1 illustrates an example of such a system that uses a combination of information from the application and cheap architecture-level techniques to detect errors. When an error occurs, mechanisms at higher levels in the stack correct the error, efficiently delivering correct operation to the user in spite of errors at the device or circuit levels. In the realms of memory and communication, engineers have a long history of success in tolerating unpredictable effects such as fabrication variability, transient upsets, and lifetime wear using information sharing, limited redundancy, and cross-layer approaches that anticipate, accommodate, and suppress errors. Networks use a combination of hardware and software to guarantee end-toend correctness. Error-detection and correction codes use additional information to correct the most common errors, single-bit transmission errors. When errors occur that cannot be corrected by these codes, the network protocol requests re-transmission of one or more packets until the correct data is received. Similarly, computer memory systems exploit a cross-layer division of labor to achieve high performance with modest hardware. Rather than demanding that hardware alone provide the virtual memory abstraction, software page-fault and TLB-miss handlers allow a modest piece of hardware, the TLB, to handle the common-case operations on a cyc1e-by-cycle basis while infrequent misses are handled in system software. Unfortunately, mitigating logic errors is not as simple or as well researched as memory or communication systems. This lack of understanding has led to very expensive solutions. For example, triple-modular redundancy masks errors by triplicating computations in either time or area. This mitigation methods imposes a 200% increase in energy consumption for every operation, not just the uncommon failure cases. At a time when computation is rapidly becoming part of our critical civilian and military infrastructure and decreasing costsfor computation are fueling our economy and our well being, we cannot afford increasingly unreliable electronics or a stagnation in capabilities per dollar, watt, or cubic meter. If researchers are able to develop techniques that tolerate the growing unpredictability of silicon devices, Moore's Law scaling should continue until at least 2022. During this 12-year time period, transistors, which are the building blocks of electronic devices, will scale their dimensions (feature sizes) from 45nm to 4.5nm.

99 GENERAL AND MISCELLANEOUS↗

How does the connectivity of open-framework conglomerates within multi-scale hierarchical fluvial architecture affect oil-sweep efficiency in waterflooding?

Understanding multi-phase fluid flow and transport processes within aquifers, candidate reservoirs for CO 2 sequestration, and petroleum reservoirs requires understanding a diverse set of geologic properties of the aquifer or reservoir, over a wide range of spatial and temporal scales. We focus on multiphase flow dynamics with wetting (e.g., water) and non-wetting (e.g., gas or oil) fluids, with one invading another. This problem is of general interest in a number of fields and is illustrated here by considering the sweep efficiency of oil during a waterflood. Using a relatively fine-resolution grid throughout a relatively large domain in these simulations and probing the results with advanced scientific visualization tools (Reservoir Visualization Analysis [RVA]/ ParaView software) promote a better understanding of how smaller-scale features affect the aggregate behavior at larger scales. We studied the effects on oil-sweep efficiency of the proportion, hierarchical organization, and connectivity of high-permeability open-framework conglomerate (OFC) cross-sets within the multi-scale stratal architecture found in fluvial deposits. We further analyzed oil production rate, water breakthrough time, and spatial and temporal distribution of residual oil saturation. As expected, the effective permeability of the reservoir exhibits large-scale anisotropy created by the organization of OFC cross-sets within unit bars, and the organization of unit bars within compound- bars. As a result, oil-sweep efficiency critically depends on the direction of the pressure gradient. However, contrary to expectations, the total amount of trapped oil due to the effect of capillary trapping does not depend on the magnitude of the pressure gradient within the examined range. Hence the pressure difference between production and injection wells does not affect sweep efficiency; although the spatial distribution of oil remaining in the reservoir depends on this value. Whether or not clusters of connected OFC span the domain affects only the absolute rate of oil production—not sweep efficiency.

58 GEOSCIENCES↗

NUMERICAL MODELING OF MULTI-WAVELENGTH SPECTRA OF M87 CORE EMISSION

Spectral fits to M87 core data from radio to hard X-ray are generated via a specially selected software suite, comprised of the High-Accuracy Relativistic Magnetohydrodynamics GRMHD accretion disk model and a two-dimensional Monte Carlo radiation transport code. By determining appropriate parameter changes necessary to fit X-ray-quiescent and flaring behavior of M87's core, we assess the reasonableness of various flaring mechanisms. This shows that an accretion disk model of M87's core out to 28 GM/c{sup 2} can describe the inner emissions. High spin rates show GRMHD-driven polar outflow generation, without citing an external jet model. Our results favor accretion rate changes as the dominant mechanism of X-ray flux and index changes, with variations in density of approximately 20% necessary to scale between the average X-ray spectrum and flaring or quiescent spectra. The best-fit parameters are black hole spin a/M > 0.8 and maximum accretion flow density n {<=} 3 Multiplication-Sign 10{sup 7} cm{sup -3}, equivalent to horizon accretion rates between m-dot = M-dot / M-dot{sub Edd}{approx}2 Multiplication-Sign 10{sup -6} and 1 Multiplication-Sign 10{sup -5} (with M-dot{sub Edd} defined assuming a radiative efficiency {eta} = 0.1). These results demonstrate that the immediate surroundings of M87's core are appropriate to explain observed X-ray variability.

79 ASTRONOMY AND ASTROPHYSICS↗

Methodological approach to the sensitivity analysis of failure effects in modern digital I and C systems - 136

Modern I and C systems of nuclear power plants increasingly use digital equipment, software-based applications for I and C functions and different types and topologies of communication networks as well. The structure, operation and communication of digital safety-related I and C systems are strongly influenced by the implemented automatic fault detection and fault treatment procedures as barriers against failure propagation. Thus, these I and C systems can change their operating states automatically during the operation time, e.g. due to the detection and correction of certain failure types. Reasonably because of these dynamic properties of digital I and C systems the use of classical fault tree and event tree methods solely for the reliability analysis of modern I and C systems is less suitable. These methods basically apply static models and do not consider the temporal changes of the operating state of the I and C system or equipment appropriately. In this paper, a recently developed approach for the sensitivity analysis of digital I and C systems will be introduced that allows to investigate the dynamic behavior of such systems in cases of internal faults and to quantify the effects on the system reliability. The development and testing of the analysis methodology is carried out using models of generic I and C systems with different typical architectures of stepwise increased complexity. (authors)

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Modeling of leachate generation from MSW landfills by a 2-dimensional 2-domain approach

The flow of water through Municipal Solid Waste (MSW) landfills is highly non-uniform and dominated by preferential pathways. Thus, concepts to simulate landfill behavior require that a heterogeneous flow regime is considered. Recent models are based on a 2-domain approach, differentiating between channel domain with high hydraulic conductivity, and matrix domain of slow water movement with high water retention capacity. These models focus on the mathematical description of rapid water flow in channel domain. The present paper highlights the importance of water exchange between the two domains, and expands the 1-dimensional, 2-domain flow model by taking into account water flows in two dimensions. A flow field consisting of a vertical path (channel domain) surrounded by the waste mass (matrix domain) is defined using the software HYDRUS-2D. When the new model is calibrated using data sets from a MSW-landfill site the predicted leachate generation corresponds well with the observed leachate discharge. An overall model efficiency in terms of r{sup 2} of 0.76 was determined for a simulation period of almost 4 years. The results confirm that water in landfills follows a preferential path way characterized by high permeability (K{sub s} = 300 m/d) and zero retention capacity, while the bulk of the landfill (matrix domain) is characterized by low permeability (K{sub s} = 0.1 m/d) and high retention capacity. The most sensitive parameters of the model are the hydraulic conductivities of the channel domain and the matrix domain, and the anisotropy of the matrix domain.

42 ENGINEERING↗

Software-defined Networking for Energy Delivery Systems (SDN4EDS): An Architectural Blueprint (Final Report)

This is the initial version of a reference for suppliers and energy companies of all sizes to deploy networks based on software-defined networking technology (SDN) to improve reliability, reduce cyber security attack surface, and facilitate mitigation of adversarial behavior. It is a living document and will progress over the life cycle of the Software-Defined Networking for Energy Delivery Systems (SDN4EDS) project. Version 2 of this report provides information on the Red Team tabletop assessment performed against the initial reference architecture. Version 3 of this report updates the reference architecture with lessons learned from the Red Team tabletop assessment, as well as provides additional details for the use cases. It also provides information on the decision process that could be used by an organization when considering deploying SDN in their environment. The final version of this report consolidates all the interim reports generated by the project into a final report. It also draws from PNNL’s experience in deploying SDN to make recommendations on how SDN could be deployed in a utility environment, and provides rationale for those decisions allowing individual utilities to make risk-based and knowledge-based decisions on how to best deploy SDN in their own environment

97 MATHEMATICS AND COMPUTING↗

Performance and energy impact of OpenMP runtime configurations on power constrained systems

Energy consumption of an application has attained the same vitality as execution time in current HPC systems, primarily due to the massive energy consumption of these systems and consequently substantial energy bills. This fact forced software developers as well as hardware vendors to put an extensive focus on energy consumption. This focus becomes even more crucial in power constrained systems, where the amount of power dedicated to applications is limited. In such systems, finding the optimal balance between execution time and energy consumption has a significant impact on utilizing these systems efficiently. A programming model is a necessary layer where optimizations can be applied to find the optimal balance. OpenMP is a standard programming model for intra-node parallelism. In this paper, we give a detailed analysis of how to optimize the execution time and energy consumption of an OpenMP application using the OpenMP runtime environment at different power levels. We studied twenty-eight OpenMP parallel regions from five NAS Parallel Benchmark (NPB) applications. Based on the study, we show that for a given power level, a suitable selection of OpenMP runtime parameters can improve the execution time and energy consumption of a parallel region up to 67% and 72%, respectively. We also show that these fine-grained improvements resulted in up to 26% of execution time and 38% of energy consumption improvement for a given OpenMP application. We finally observed that optimizing the energy consumption behavior alone across all power levels regardless of execution time behavior can lead to an additional energy consumption improvement of up to 55%. However, this improvement comes at the expense of execution time.

97 MATHEMATICS AND COMPUTING↗

Measuring Thread Timing to Assess the Feasibility of Early-Bird Message Delivery Across Systems and Scales

Early-bird communication is a communication/computation overlap technique that leverages fine-grained communication to improve application run-time. Communication is divided such that each individual thread can initiate transmission of its portion of the data upon completion rather than waiting for a dedicated communication phase. The benefit of early-bird communication depends on the completion timing of the individual threads: On the one hand, if all threads are complete at nearly the same time, the overheads of sending multiple messages will accumulate, leading to performance that is worse than if a single message had been sent. On the other hand, if thread completions are spread out in time, those that complete earlier can send data while others continue working, leading to performance that is better than if a single message had been sent. The challenge is that the completion times are currently unknown and can vary based on application, problem size, system software, and underlying hardware. In this paper, we address this lacuna by measuring and evaluating the potential overlap afforded by early-bird communication for a selection of proxy applications. These measurements help us understand whether a given application could benefit from early-bird communication. Here, we present our technique for gathering this data and evaluate data collected from three proxy applications: MiniFE, MiniMD, and MiniQMC. Each application is run on three systems with distinct CPU architectures and strong scales across three run sizes. To characterize the behavior of these workloads, we study the trends of thread timings at both a macro level, across all threads across all runs of an application, and a micro level, that is, within a single process of a single run. We observe that our tested applications exhibit significantly different thread arrival distributions. The machine used had a significant impact, with the window of potential overlap varying by as much as an order of magnitude.

97 MATHEMATICS AND COMPUTING↗

The Corrected Distortion model for Lagrangian spray simulation of transcritical fuel injection

In this work, we present a detailed implementation and validation of the droplet modeling framework proposed by Dahms and Oefelein (2016) into the engine commercial CFD software CONVERGE using the User Defined Function (UDF) interface. The model accounts for the nonlinear deformation and oscillation experienced by liquid spray droplet injected into high pressure and temperature. Lagrangian spray simulations of Engine Combustion Network (ECN) Spray A are performed. Model validation against standard experimental measurements of liquid velocity, vapor mixture fraction is conducted. To perform more rigorous model validation, new experimental measurements based on Diffused Back Illumination (DBI) are introduced. The new measurements are processed for Projected Liquid Volume (PLV), which offers as close as possible one-to-one model validation for liquid penetration while offering new insights into the spray physics. Comparison with a One-D model based on adiabatic mixing theory by Siebers (1999) and Desantes et al. (2007) are also conducted. Through these model validation exercises, it is shown that the new framework improves liquid-phase penetration predictions, following a tendency for enhanced evaporation, compared to the standard approach for both Reynolds Average Navier Stokes (RANS) and Large Eddy Simulation (LES). Additionally, at the liquid length, maximum mixture fraction values predicted by the new approach are in good agreement those of an adiabatic mixing model. Qualitative analysis of the spray behaviors during the early stage of the injection process reveals that the proposed framework predicts significant increase in droplet evaporation rate with lower drop drag compared to the current standard approach.

42 ENGINEERING↗