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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 1,459 records · Page 81

Multiobjective Hyperparameter Optimization for Deep Learning Interatomic Potential Training Using NSGA-II

Deep neural network (DNN) potentials are an emerging tool for simulation of dynamical atomistic systems, with the promise of quantum mechanical accuracy at speedups of 10000$\times$. As with other DNN methods, hyperparameters used during training can make a substantial difference in model accuracy, and optimal settings vary with dataset. To enable rapid tuning of hyperparameters for DNN potential training, we developed a scalable multiobjective optimization evolutionary algorithm for supercomputers and tested it on the Summit system at the Oak Ridge Leadership Computing Facility (OLCF). The multiobjective approach is required due to the coupling of two learned values defining the potential: the energy and force. Using a large-scale implementation of the NSGA-II algorithm adapted for training DNN potentials, we discovered several optimal multiobjective combinations, including best choices of activation functions, learning rate scaling scheme, and pairing of the two radial cutoffs used in the three dimensional descriptor function.

Coletti, Mark↗

Speed Optimizations for Physics Ray Trace Algorithms

Ray tracing is a process used commonly in computer graphics and in physics to track light photons and particles, respectively. Much research was found on improving execution times for the computer graphics applications; however, in the short time frame of this literary review, almost no research was found on improving the execution times for the physics applications that were relevant to this problem. Two ray trace algorithms, a STL raytrace and a conebeam raytrace, were optimized using OpenMP and CUDA.

97 MATHEMATICS AND COMPUTING↗

Preliminary software development for optical mirror figure control

The maintenance of accurate primary mirror figure in the face of environmental disturbances is the key to the achievement of diffraction-limited performance in a large space telescope. In order to develop the concepts of optical mirror figure control, an experimental program was initiated. A major component in this experiment will be an XDS Sigma 5.7 digital computer which will realize the control algorithm. A software package is described which realizes linear optimal, simplified linear, and iterative optimal control algorithms. The software, in addition, provides for interactive communication between the operator and the computer, and interaction between the computer and the experimental hardware elements. A brief description of a small hybrid computer system is also presented.

Mackinnon, D.↗

A stiffly-stable implicit Runge-Kutta algorithm for CFD applications

A stiffly-stable implicit Runge-Kutta integration algorithm is derived for CFD applications spanning the range of semidiscrete theories. The algorithm family contains the one-step 'theta' algorithms, including backwards Euler and the trapezoidal rule, and provides a versatile framework to identify expressions governing algorithm stability characteristics. Parameters of a Runge-Kutta optimal implicit algorithm, second-order accurate in time and stiffly-stable, are established. This algorithm is implemented within a weak statement finite element semidiscrete formulation for one- and two-dimensional conservation law systems. Numerical results are compared to theta-algorithm solutions, for unsteady quasi-one-dimensional Euler predictions with shocks, and for a specially derived two-dimensional conservation law system modeling the Euler equations.

Baker, A. J.↗

Global Precipitation Measurement (GPM) Mission: Precipitation Processing System (PPS) GPM Mission Gridded Text Products Provide Surface Precipitation Retrievals

In February 2015, the Global Precipitation Measurement (GPM) mission core satellite will complete its first year in space. The core satellite carries a conically scanning microwave imager called the GPM Microwave Imager (GMI), which also has 166 GHz and 183 GHz frequency channels. The GPM core satellite also carries a dual frequency radar (DPR) which operates at Ku frequency, similar to the Tropical Rainfall Measuring Mission (TRMM) Precipitation Radar, and a new Ka frequency. The precipitation processing system (PPS) is producing swath-based instantaneous precipitation retrievals from GMI, both radars including a dual-frequency product, and a combined GMIDPR precipitation retrieval. These level 2 products are written in the HDF5 format and have many additional parameters beyond surface precipitation that are organized into appropriate groups. While these retrieval algorithms were developed prior to launch and are not optimal, these algorithms are producing very creditable retrievals. It is appropriate for a wide group of users to have access to the GPM retrievals. However, for researchers requiring only surface precipitation, these L2 swath products can appear to be very intimidating and they certainly do contain many more variables than the average researcher needs. Some researchers desire only surface retrievals stored in a simple easily accessible format. In response, PPS has begun to produce gridded text based products that contain just the most widely used variables for each instrument (surface rainfall rate, fraction liquid, fraction convective) in a single line for each grid box that contains one or more observations.This paper will describe the gridded data products that are being produced and provide an overview of their content. Currently two types of gridded products are being produced: (1) surface precipitation retrievals from the core satellite instruments GMI, DPR, and combined GMIDPR (2) surface precipitation retrievals for the partner constellation satellites. Both of these gridded products are generated for a.25 degree x.25 degree hourly grid, which are packaged into daily ASCII (American Standard Code for Information Interchange) files that can downloaded from the PPS FTP (File Transfer Protocol) site. To reduce the download size, the files are compressed using the gzip utility.This paper will focus on presenting high-level details about the gridded text product being generated from the instruments on the GPM core satellite. But summary information will also be presented about the partner radiometer gridded product. All retrievals for the partner radiometer are done using the GPROF2014 algorithmusing as input the PPS generated inter-calibrated 1C product for the radiometer.

precipitation↗

Implementation of a Point Algorithm for Real-Time Convex Optimization

The primal-dual interior-point algorithm implemented in G-OPT is a relatively new and efficient way of solving convex optimization problems. Given a prescribed level of accuracy, the convergence to the optimal solution is guaranteed in a predetermined, finite number of iterations. G-OPT Version 1.0 is a flight software implementation written in C. Onboard application of the software enables autonomous, real-time guidance and control that explicitly incorporates mission constraints such as control authority (e.g. maximum thrust limits), hazard avoidance, and fuel limitations. This software can be used in planetary landing missions (Mars pinpoint landing and lunar landing), as well as in proximity operations around small celestial bodies (moons, asteroids, and comets). It also can be used in any spacecraft mission for thrust allocation in six-degrees-of-freedom control.

Acikmese, Behcet↗

Development of Genetic Algorithm Based Multi-Objective Plant Reload Optimization Platform

The U.S. nuclear industry is facing a challenge in maintaining required levels of safety while ensuring economic competitiveness to stay in business. Safety remains a key parameter for all aspects of light-water reactor nuclear power plant operations. Safety can become more economical by using a risk-informed ecosystem, such as the one being developed in the Risk-Informed Systems Analysis Pathway under the U.S. Department of Energy Light Water Reactor Sustainability Program. The Light Water Reactor Sustainability Program promotes a wide range of research and development activities to maximize both the safety and economic efficiency of nuclear power plants through improved scientific understanding, especially given that many plants are now considering second license renewals. The Risk-Informed Systems Analysis Pathway has two main goals: Deploy methodologies and technologies that better represent safety margins and cost and safety factors; Develop advanced applications that enable cost-effective plant operations. The Plant Reload Optimization Platform development project aims to build a reactor core design tool that includes reactor safety and fuel performance analyses and uses artificial intelligence to support the optimization of core design solutions. This report summarizes genetic-algorithm-based multi-objective fuel reload optimization activities, specifically: Developing the non-dominated sorting genetic algorithm II optimizer in the Risk Analysis and Virtual ENviroment (RAVEN); Demonstrating and validating the developed non-dominated sorting genetic algorithm II optimizer using benchmark optimization problems.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Solid State Power Substation DC Node Optimization and Controller Hardware-In-The-Loop Demonstration

A solid state power substation (SSPS) node is a microgrid that integrates distributed energy resources and loads and injects/absorbs power to/from the SSPS distribution network. It is an essential building block of a futuristic distribution grid network. This paper presents the development and demonstration of optimization use cases of a SSPS DC node. By adopting multi-layer hierarchical control architecture and developing automatic device identification and dynamic optimization formulation algorithms, the SSPS DC node can perform plug-and-play resource integration and seamless transition of the optimized node operation under on and off grid condition without sophisticated algorithms, control mode changes, and user interactions. Four optimization use cases including economic dispatches with price signal changes, a sudden PV power drop, and a single directional meter and its associated costs with sending power back to the grid, and resiliency under a grid inverter trip condition were demonstrated through the real-time controller hardware-in-the-loop simulation.

Kim, Namwon↗

Optimal Power Dispatch of DGs in Radial and Mesh AC Grids: A Hybrid Solution Methodology between the Salps Swarm Algorithm and Successive Approximation Power Flow Method

In this paper, we address the problem of the optimal power dispatch of Distributed Generators (DGs) in Alternating Current (AC) networks, better known as the Optimal Power Flow (OPF) problem. We used, as the objective function, the minimization of power losses (P loss ) associated with energy transport, which are subject to the set of constraints that compose AC networks in an environment of distributed generation. To validate the effectiveness of the proposed methodology in solving the OPF problem in any network topology, we employed one 10-node mesh test system and three radial text systems: 10, 33, and 69 nodes. In each test system, DGs were allowed to inject 20%, 40%, and 60% of the power supplied by the slack generator in the base case. To solve the OPF problem, we used a master–slave methodology that integrates the optimization method Salps Swarm Algorithm (SSA) and the load flow technique based on the Successive Approximation (SA) method. Moreover, for comparison purposes, we employed some of the algorithms reported in the specialized literature to solve the OPF problem (the continuous genetic algorithm, the particle swarm optimization algorithm, the black hole algorithm, the antlion optimization algorithm, and the Multi-Verse Optimizer algorithm), which were selected because of their excellent results in solving such problems. The results obtained by the proposed solution methodology demonstrate its superiority and convergence capacity in terms of minimization of P loss in both radial and mesh systems. It provided the best reduction in minimum P loss in short processing times and showed excellent repeatability in each test system and scenario under analysis.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

A First-order Prediction-Correction Algorithm for Time-varying (Constrained) Optimization: Preprint

This paper focuses on the design of online algorithms based on prediction-correction steps to track the optimal solution of a time-varying constrained problem. Existing prediction-correction methods have been shown to work well for unconstrained convex problems and for settings where obtaining the inverse of the Hessian of the cost function can be computationally affordable. The prediction-correction algorithm proposed in this paper addresses the limitations of existing methods by tackling constrained problems and by designing a first-order prediction step that relies on the Hessian of the cost function (and do not require the computation of its inverse). Analytical results are established to quantify the tracking error. Numerical simulations corroborate the analytical results and showcase performance and benefits of the algorithms.

97 MATHEMATICS AND COMPUTING↗

A Hierarchical Optimization Method for Electric Vertical Takeoff and Landing Aircraft Network Design

Electric vertical takeoff and landing aircraft (eVTOLs) are expected to serve urban air mobility in a station-to-station configuration, which makes the optimal network design of eVTOL stations a critical question to explore. Existing approaches often face limitations, such as the inability to interact station locations with demand or difficulty in finding the optimal solution for large study regions. Here, this paper first proposes a mathematical model to generate optimal eVTOL station locations while considering associated potential eVTOL demand, and then proposes a heuristic algorithm, Hierarchical Optimization MEthod (HOME), to efficiently solve the model. With a case study of Southern California, HOME was compared to 1) directly solving the original integer linear programming-based network design problem, and 2) employing the widely used genetic algorithm. Results suggest that HOME can find optimal solutions with limited computational resources. The proposed framework powered by HOME provides a computationally efficient way to support urban air mobility planning.

97 MATHEMATICS AND COMPUTING↗

Bounded-Degree Approximations of Stochastic Networks

We propose algorithms to approximate directed information graphs. Directed information graphs are probabilistic graphical models that depict causal dependencies between stochastic processes in a network. The proposed algorithms identify optimal and near-optimal approximations in terms of Kullback-Leibler divergence. The user-chosen sparsity trades off the quality of the approximation against visual conciseness and computational tractability. One class of approximations contains graphs with speci ed in-degrees. Another class additionally requires that the graph is connected. For both classes, we propose algorithms to identify the optimal approximations and also near-optimal approximations, using a novel relaxation of submodularity. We also propose algorithms to identify the r-best approximations among these classes, enabling robust decision making.

97 MATHEMATICS AND COMPUTING↗

Optimization and supervised machine learning methods for fitting numerical physics models without derivatives

Here, we address the calibration of a computationally expensive nuclear physics model for which derivative information with respect to the fit parameters is not readily available. Of particular interest is the performance of optimization-based training algorithms when dozens, rather than millions or more, of training data are available and when the expense of the model places limitations on the number of concurrent model evaluations that can be performed. As a case study, we consider the Fayans energy density functional model, which has characteristics similar to many model fitting and calibration problems in nuclear physics. We analyze hyperparameter tuning considerations and variability associated with stochastic optimization algorithms and illustrate considerations for tuning in different computational settings.

97 MATHEMATICS AND COMPUTING↗

A Transfer Learning Strategy for Improving the Data Efficiency of Deep Reinforcement Learning Control in Smart Buildings

Reinforcement learning (RL) is a powerful tool that has shown promising results in many domains such as robotics and game-playing. Because RL algorithms learn optimal control policies by continuously interacting with their environments, these algorithms require a lot of data to learn, which limits their application to a wide range of domains. For this reason, there is an immense need for improving the training and data efficiency of RL. Towards addressing this research gap, this paper proposes a transfer learning (TL) approach to improve the efficiency of the RL algorithms by reducing data need and, thus, reducing training time. To demonstrate the proposed approach, a knowledge transfer from a set of buildings to another building was conducted. The results show that the proposed TL approach is a promising method that can efficiently harness the information from similar RL tasks and reduce the data needs of RL algorithms.

Amasyali, Kadir↗

Precision Computations in Strongly Coupled Conformal Field Theories (Final Technical Report)

Conformal Field Theories (CFTs) are quantum field theories that are invariant under the conformal symmetry group (which includes translations and rotations, but also local rescalings of spacetime). They are building blocks of general quantum field theories, and appear in many areas of physics, including statistical physics, condensed matter physics, particle physics, and quantum gravity. Because of their extra symmetries, the mathematical structure of CFTs is tightly constrained, and this leads to the idea of the ``conformal bootstrap," which is to use these mathematical structures to constrain, and in some cases determine, CFT observables. A new numerical implementation of the conformal bootstrap idea appeared in 2008 with the work of Rattazzi, Rychkov, Tonni, and Vichi. Their observation was that certain bootstrap constraints (conformal symmetry and unitarity) could be combined to yield a convex optimization problem that constraints CFT data. By solving this convex optimization problem on a computer, one could obtain bounds on observables like critical exponents and operator product expansion (OPE) coefficients. Over the course of this award, the PI has improved numerical bootstrap techniques by optimizing known algorithms and finding new ones for performing the required convex optimization computations. The PI has applied these techniques to compute high-precision observables in several important strongly-coupled systems. The PI has also explored both analytical and numerical bootstrap methods for constraining the space of low energy effective field theories of quantum gravity, and developed new analytical techniques for CFT and QFT more broadly.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Placement Of Exciters And Sensors To Measure Vibrations

Report discusses use of simulated-annealing algorithm to place exciters and sensors of vibrations at nearly optimal positions in complicated structure. Because there are generally fewer exciters and sensors than degrees of freedom in structure, optimal-placement algorithm needed to maximize value of resulting incomplete set of measurements for verification of amplitudes and frequencies of previously-computed vibrational modes.

Salama, Moktar A.↗