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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 505 records · Page 28

Using Computer Simulations to Optimize Biofuel Production

The DOE strives to ensure America's security and prosperity by addressing energy challenges. NREL shares this goal and tries to achieve a clean energy world. Fossil fuels are problematic for both organizations. Using them endangers American security. Their supply is finite and burning them causes environmental damage. Biofuels are a good alternative to fossil fuels. They are renewably produced on American soil and can lower greenhouse gas emissions. Also, cars and planes need no costly mechanical adjustments to use biofuels. However, the fuels themselves are expensive. For my SULI project, I reduced the cost of biofuels by optimizing the production process through computer simulations. Existing simulations were accurate but slow. One simulation takes up to eight hours, and researchers must do hundreds. My solution reduces the computing time. I treated the biomass particles in the simulation as one-dimensional. That simplified the simulation equations, making them easier for the computer to solve. Still, biomass particles are three-dimensional. The 1D assumption was wrong and produced inaccurate results. To maintain accuracy while increasing speed, I developed a method to convert 1D simulation results into usable 3D data. I adjusted the 1D simulation until the output matched the 3D results for a specific environment. I found out how much the simulation changed when the environment changed. Machine learning algorithms defined a relationship between 1D and 3D data for all environments. This lets scientists convert fast 1D simulation results into valid 3D data.

1D↗

Are we witnessing the spectre of an HPC meltdown?: Are We Witnessing the Spectre of an HPC Meltdown?

In this study, we measure and analyze the performance observed when running applications and benchmarks before and after the Meltdown and Spectre fixes have been applied to the Cray supercomputers and supporting systems at the Oak Ridge Leadership Computing Facility (OLCF). Of particular interest is the effect of these fixes on applications selected from the OLCF portfolio when running at scale. This comprehensive study presents results from experiments run on Titan, Eos, Cumulus, and Percival supercomputers at the OLCF. Lastly, the results from this study are useful for HPC users running on Cray supercomputers and serve to better understand the impact that these two vulnerabilities have on diverse HPC workloads at scale.

97 MATHEMATICS AND COMPUTING↗

A likelihood ratio anomaly detector for identifying within-perimeter computer network attacks

The rapid detection of attackers within firewalls of enterprise computer networks is of paramount importance. Anomaly detectors address this problem by quantifying deviations from baseline statistical models of normal network behavior and signaling an intrusion when the observed data deviates significantly from the baseline model. But, many anomaly detectors do not take into account plausible attacker behavior. As a result, anomaly detectors are prone to a large number of false positives due to unusual but benign activity. Our paper first introduces a stochastic model of attacker behavior which is motivated by real world attacker traversal. Then, we develop a likelihood ratio detector that compares the probability of observed network behavior under normal conditions against the case when an attacker has possibly compromised a subset of hosts within the network. Since the likelihood ratio detector requires integrating over the time each host becomes compromised, we illustrate how to use Monte Carlo methods to compute the requisite integral. We then present Receiver Operating Characteristic (ROC) curves for various network parameterizations that show for any rate of true positives, the rate of false positives for the likelihood ratio detector is no higher than that of a simple anomaly detector and is often lower. Finally, we demonstrate the superiority of the proposed likelihood ratio detector when the network topologies and parameterizations are extracted from real-world networks.

97 MATHEMATICS AND COMPUTING↗

Transition metal-embedded two-dimensional C 3 N as a highly active electrocatalyst for oxygen evolution and reduction reactions

Searching for highly efficient, stable and cost-effective catalysts for oxygen evolution reaction (OER) and oxygen reduction reaction (ORR) is vital to resolve energy security and environmental problems. Herein, by means of computational screening based on the density functional theory (DFT), we studied a wide range of transition metal (TM) atoms embedded into the double carbon vacancy of C 3 N monolayers (V CC ), denoted as TM-V CC (TM = Mn, Fe, Co, Ni, Cu, Ru, Rh, Pd, Ir and Pt), as efficient single-atom catalysts (SACs) for OER and ORR. The calculated results showed that all the considered TM-V CC composites exhibited a metallic feature that ensured efficient charge transfer during reactions. The interaction strength between intermediates and TM-V CC has direct correlation with the d-band center of TM, which can be tuned by changing the TM atoms with different numbers of d electrons. The best catalyst for OER was Rh-V CC with an overpotential (η OER ) of 0.35 V, followed by Co-V CC (0.43 V). For the ORR process, Rh-V CC exhibited the lowest ORR overpotential (η ORR ) of 0.27 V, followed by Co-V CC (0.42 V). The results suggested that the performances of the newly predicted Rh-V CC and Co-V CC SACs are comparable to those of the noble-metal benchmark catalysts for OER and ORR. Ab initio molecular dynamic simulations indicated that Rh-V CC and Co-V CC SACs could remain stable under 300 K and possessed high energy barriers to prevent the isolated Rh and Co atoms from clustering. Here our results highlight a new family of efficient and stable catalysts with a single atom anchored on carbon nitride-based materials, which provides a useful guideline for catalyst design and practical applications.

36 MATERIALS SCIENCE↗

Privacy-Preserving Federated Learning for Science: Challenges and Research Directions

This paper discusses the key challenges and future research directions for privacy-preserving federated learning (PPFL), with a focus on its application to large-scale scientific AI models, in particular, foundation models~(FMs). PPFL enables collaborative model training across distributed datasets while preserving privacy-- an important collaborative approach for science. We discuss the need for efficient and scalable algorithms to address the increasing complexity of FMs, particularly when dealing with heterogeneous clients. In addition, we underscore the need for developing advance privacy-preserving techniques, such as differential privacy, to balance privacy and utility in large FMs emphasizing fairness and incentive mechanisms to ensure equitable participation among heterogeneous clients. Finally, we emphasize the need for a robust software stack supporting scalable and secure PPFL deployments across multiple high-performance computing facilities. We envision that PPFL would play a crucial role to advance scientific discovery and enable large-scale, privacy-aware collaborations across science domains.

Kim, Kibaek [Argonne National Laboratory (ANL)]↗

Security and Privacy Grand Challenges for the Internet of Things

Abstract— The growth of the Internet of Things (IoT) is driven by market pressures, and while security is being considered, the relationship between the unintended consequences of billions of such devices connecting to the Internet cannot be described with existing mathematical methods. The possibilities for illicit surveillance through lifestyle analysis, unauthorized access to information, and new attack vectors will continue to increase by 2020, when up-to 50 billion devices may be connected. This paper discusses various kinds of vulnerabilities that can be expected to arise, and presents a research agenda for mitigating the worst of the impacts. We hope to draw research attention to the potential dangers of IoT so that many of these problems can be avoided.

grand challenge↗

A Trilevel Model for Segmentation of the Power Transmission Grid Cyber Network

Network segmentation of a power grid's communication system can make the grid more resilient to cyberattacks. Here we develop a novel trilevel programming model to optimally segment a grid communication system, taking into account the actions of an information technology (IT) administrator, attacker, and grid operator. The IT administrator is allowed to segment existing networks, and the attacker is given a budget to inflict damage on the grid by attacking the segmented communication system. Finally, the grid operator can redispatch the grid after the attack to minimize damage. The resulting problem is a trilevel interdiction problem that we solve using a branch and bound algorithm for bilevel problems. We demonstrate the benefits of optimal network segmentation through case studies on the 9-bus Western System Coordinating Council (WSCC) system and the 30-bus IEEE system. These examples illustrate that network segmentation can significantly reduce the threat posed by a cyberattacker.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Advanced Computing is at the Forefront of a New “Moonshot” Revolutionizing the North American Power Grid

In the 50+ years since the first humans landed on the moon, computing has grown at breakneck speed. We are faced with another challenge that is just as daunting, and just as important to overcome-modernizing the North American electric power grid-and high-performance computing (HPC) systems with specialized software will be an important element in rising to this challenge. We describe at a high level how software developed in the ExaSGD project addresses this "moonshot" goal by utilizing exascale computing and a novel high performance solver software stack to support the mission of decarbonizing power grid operations in an environment of uncertain weather and climate. To reach the exascale benchmark the team has made a number of first-of-their-kind innovations, including novel method for stochastic optimization, fine grained parallel methods for modeling power systems, and GPU resident sparse numerical linear solvers.

17 WIND ENERGY↗

Machine Learning Based Resilience Testing of an Address Randomization Cyber Defense

Moving target defenses (MTDs) are widely used as an active defense strategy for thwarting cyberattacks on cyber-physical systems by increasing diversity of software and network paths. Recently, machine Learning (ML) and deep Learning (DL) models have been demonstrated to defeat some of the cyber defenses by learning attack detection patterns and defense strategies. It raises concerns about the susceptibility of MTD to ML and DL methods. Here, in this article, we analyze the effectiveness of ML and DL models when it comes to deciphering MTD methods and ultimately evade MTD-based protections in real-time systems. Specifically, we consider a MTD algorithm that periodically randomizes address assignments within the MIL-STD-1553 protocol—a military standard serial data bus. Two ML and DL-based tasks are performed on MIL-STD-1553 protocol to measure the effectiveness of the learning models in deciphering the MTD algorithm: 1) determining whether there is an address assignments change i.e., whether the given system employs a MTD protocol and if it does 2) predicting the future address assignments. The supervised learning models (random forest and k-nearest neighbors) effectively detected the address assignment changes and classified whether the given system is equipped with a specified MTD protocol. On the other hand, the unsupervised learning model (K-means) was significantly less effective. The DL model (long short-term memory) was able to predict the future addresses with varied effectiveness based on MTD algorithm's settings.

45 MILITARY TECHNOLOGY, WEAPONRY, AND NATIONAL DEF↗

Netload Range Cost Curves for Coordinated Transmission-Distribution Planning Under DER Growth Uncertainty

The increasing penetration of distributed energy resources (DERs) requires better coordination between transmission and distribution (T&D) planning to ensure system security and cost efficiency. However, misaligned planning horizons, computational burdens, and privacy concerns hinder effective coordination, leading to either underutilized resources caused by overinvestments or reliability risks due to underinvestment. To address this challenge, we introduce netload range cost curves (NRCCs), a novel approach for managing long-term DER growth uncertainty through T&D coordination, while preserving existing data-sharing and regulatory structures. NRCCs provide pairs of (i) peak substation netload guarantees and (ii) corresponding distribution upgrade options and costs, enabling their seamless integration into transmission planning workflows. To compute NRCCs efficiently, we develop a transmission-aware distribution network planning (TADNP), which is subsequently integrated to an iterative computation procedure. These NRCCs are then embedded into an NRCC-informed transmission planning model to enable resource-efficient coordination. We illustrate our proposed approach with a case study based on realistic distribution and transmission systems in the San Francisco Bay Area, California. Our results indicate the possibility of dramatic savings in transmission investments by incorporating the proposed NRCC-integrated T&D coordination framework.

Li, Yujia↗

Resilient State Recovery Using Prior Measurement Support Information

Resilient state recovery of cyber-physical systems has attracted much research attention due to the unique challenges posed by the tight coupling between communication, computation, and the underlying physics of such systems. By modeling attacks as additive adversary signals to a sparse subset of measurements, this resilient recovery problem can be formulated as an error correction problem. To achieve exact state recovery, most existing results require less than 50% of the measurement nodes to be compromised, which limits the resiliency of the estimators. In this paper, we show that observer resiliency can be further improved by incorporating data-driven prior information. Here, we provide an analytical bridge between the precision of prior information and the resiliency of the estimator. By quantifying the relationship between the estimation error of the weighted ℓ 1 observer and the precision of the support prior, this quantified relationship provides guidance for the estimator’s weight design to achieve optimal resiliency. Several numerical simulations and an application case study are presented to validate the theoretical claims.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Secure API-Driven Research Automation to Accelerate Scientific Discovery

The Secure Scientific Service Mesh (S3M) provides API-driven infrastructure to accelerate scientific discovery through automated research workflows. By integrating near real-time streaming capabilities, intelligent workflow orchestration, and fine-grained authorization within a service mesh architecture, S3M enables secure and flexible programmatic access to high performance computing (HPC) resources. This framework allows intelligent agents and experimental facilities to dynamically provision resources and execute complex workflows, accelerating experimental lifecycles, and enabling AI-augmented autonomous science. S3M establishes a modern foundation for scientific computing infrastructure that significantly reduces traditional barriers between researchers, computational resources, and experimental facilities.

Skluzacek, Tyler [ORNL] (ORCID:0000000322424931)↗

PF-WFS Shell Inspection Update December 2016

Since the last project update in FY16:Q2, PF-WFS personnel have advanced in understanding of shell inspection on Coordinate Measuring Machines {CMM} and refined the PF-WFS process to the point it was decided to convert shell inspection from the Sheffield #1 gage to Lietz CM Ms. As a part of introspection on the quality of this process many sets of data have been reviewed and analyzed. This analysis included Sheffield to CMM comparisons, CMM inspection repeatability, fixturing differences, quality check development, probing approach changes. This update report will touch on these improvements that have built the confidence in this process to mainstream it inspecting shells. In addition to the CMM programming advancements, the continuation in refinement of input and outputs for the CMM program has created an archiving scheme, input spline files, an output metafile, and inspection report package. This project will continue to mature. Part designs may require program modifications to accommodate "new to this process" part designs. Technology limitations tied to security and performance are requiring possible changes to computer configurations to support an automated process.

42 ENGINEERING↗

Improved Hybrid Modeling of Spent Fuel Storage Facilities

This work developed a new computational method for improving the ability to calculate the neutron flux in deep-penetration radiation shielding problems that contain areas with strong streaming. The “gold standard” method for radiation transport is Monte Carlo (MC) as it samples the physics exactly and requires few approximations. Historically, however, MC was not useful for shielding problems because of the computational challenge of following particles through dense shields. Instead, deterministic methods, which are superior in term of computational effort for these problems types but are not as accurate, were used. Hybrid methods, which use deterministic solutions to improve MC calculations through a process called variance reduction, can make it tractable from a computational time and resource use perspective to use MC for deep-penetration shielding. Perhaps the most widespread and accessible of these methods are the Consistent Adjoint Driven Importance Sampling (CADIS) and Forward-Weighted CADIS (FW-CADIS) methods. For problems containing strong anisotropies, such as power plants with pipes through walls, spent fuel cask arrays, active interrogation, and locations with small air gaps or plates embedded in water or concrete, hybrid methods are still insufficiently accurate. In this work, a new method for generating variance reduction parameters for strongly anisotropic, deep penetration radiation shielding studies was developed. This method generates an alternate form of the adjoint scalar flux quantity, Φ Ω , which is used by both CADIS and FW-CADIS to generate variance reduction parameters for local and global response functions, respectively. The new method, called CADIS-Ω, was implemented in the Denovo/ADVANTG software. Results indicate that the flux generated by CADIS-Ω incorporates localized angular anisotropies in the flux more effectively than standard methods. CADIS-Ω outperformed CADIS in several test problems. This initial work indicates that CADIS- may be highly useful for shielding problems with strong angular anisotropies. This is a benefit to the public by increasing accuracy for lower computational effort for many problems that have energy, security, and economic importance.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Desktop security

Explore the source record for details and available documents.

security↗

Software Supports Distributed Operations via the Internet

Multi-mission Encrypted Communication System (MECS) is a computer program that enables authorized, geographically dispersed users to gain secure access to a common set of data files via the Internet. MECS is compatible with legacy application programs and a variety of operating systems. The MECS architecture is centered around maintaining consistent replicas of data files cached on remote computers. MECS monitors these files and, whenever one is changed, the changed file is committed to a master database as soon as network connectivity makes it possible to do so. MECS provides subscriptions for remote users to automatically receive new data as they are generated. Remote users can be producers as well as consumers of data. Whereas a prior program that provides some of the same services treats disconnection of a user from the network of users as an error from which recovery must be effected, MECS treats disconnection as a nominal state of the network: This leads to a different design that is more efficient for serving many users, each of whom typically connects and disconnects frequently and wants only a small fraction of the data at any given time.

Norris, Jeffrey↗

Cloud Computing Option for Modeling the Debris Environment

NASA’s Digital Transformation Initiative aims to promote the agency’s adoption of current and evolving digital technologies. Through agency-wide collaboration with other NASA teams, the Office of Safety and Mission Assurance (OSMA) has directed the Orbital Debris Program Office and the Meteoroid Environment Office to integrate cloud computing technologies in their publicly released software models: the Orbital Debris Engineering Model (ORDEM) and the Meteoroid Engineering Model (MEM). Decoupling the user interface from the backend processor was key for the software packages to run on a cloud computing framework. Benefits to this design include horizontal scaling of computing resources, user authentication and authorization, and automated deployment. Both models are hosted on a cloud computing platform supported by the NASA authorized IT security and compliance framework. This paper focuses on the new ORDEM web application, which includes the current features of the publicly released ORDEM software with an upgraded frontend design. The underlying ORDEM processor is run on a cloud container, allowing the user to run multiple spacecraft and telescope/radar mode simulations. Featuresexclusive to the ORDEM web application, such as importing multiple TLEs, auto-generated plotting, and the ability to check runtime progress are discussed. Comparisons between the current ORDEM software and the web application are summarized.

Andrew Vavrin↗

Cloud Computing Option for Modeling the Debris Environment

NASA’s Digital Transformation Initiative aims to promote the agency’s adoption of current and evolving digital technologies. Through agency-wide collaboration with other NASA teams, the Office of Safety and Mission Assurance (OSMA) has directed the Orbital Debris Program Office and the Meteoroid Environment Office to integrate cloud computing technologies into their publicly released software models: the Orbital Debris Engineering Model (ORDEM) and the Meteoroid Engineering Model (MEM). Decoupling the user interface from the backend processor was key for the software packages to run on a cloud computing framework. Benefits to this design include horizontal scaling of computing resources, user authentication and authorization, and automated deployment. Both models are hosted on a cloud computing platform supported by the NASA authorized IT security and compliance framework. This paper focuses on the new ORDEM web application, which includes the current features of the publicly released ORDEM software with an upgraded frontend design, although parallels between ORDEM and MEM are also discussed. The underlying ORDEM processor is run on a cloud container, allowing the user to run multiple spacecraft and telescope/radar mode simulations. Features exclusive to the ORDEM web application, such as importing multiple TLEs, auto-generated plotting, and the ability to check runtime progress are discussed. Comparisons between the current ORDEM software and the web application are summarized.

Andrew Vavrin↗