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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 73 records · Page 4

Efficient exact exchange using Wannier functions and other related developments in planewave-pseudopotential implementation of RT-TDDFT

The plane-wave pseudopotential (PW-PP) formalism is widely used for the first-principles electronic structure calculation of extended periodic systems. The PW-PP approach has also been adapted for real-time time-dependent density functional theory (RT-TDDFT) to investigate time-dependent electronic dynamical phenomena. In this work, we detail recent advances in the PW-PP formalism for RT-TDDFT, particularly how maximally localized Wannier functions (MLWFs) are used to accelerate simulations using the exact exchange. We also discuss several related developments, including an anti-Hermitian correction for the time-dependent MLWFs (TD-MLWFs) when a time-dependent electric field is applied, the refinement procedure for TD-MLWFs, comparison of the velocity and length gauge approaches for applying an electric field, and elimination of long-range electrostatic interaction, as well as usage of a complex absorbing potential for modeling isolated systems when using the PW-PP formalism.

Chemistry

aiida-flux-scheduler

AiiDA is a workflow management software that is capable of accelerating simulations on HPC machines. Currently, there is no scheduler plugin for flux. The current code that is being submitted to be released is the initial alpha version. The code will be hosted on the external LLNL github group.

Keilbart, Nathan [Lawrence Livermore National Labo

Evaluation of data driven low-rank matrix factorization for accelerated solutions of the Vlasov equation

Low-rank methods have shown success in accelerating simulations of a collisionless plasma described by the Vlasov equation, but still rely on computationally costly linear algebra every time step. We propose a data-driven factorization method using artificial neural networks, specifically with convolutional layer architecture, that trains on existing simulation data. At inference time, the model outputs a low-rank decomposition of the distribution field of the charged particles, and we demonstrate that this step is faster than the standard linear algebra technique. Numerical experiments show that the method achieves comparable reconstruction accuracy for interpolation tasks, generalizing to unseen test data in a manner beyond just memorizing training data; patterns in factorization also inherently followed the same numerical trend as those within algebraic methods (e.g., truncated singular-value decomposition). However, when training on the first 70% of a time-series data and testing on the remaining 30%, the method fails to meaningfully extrapolate. Despite this limiting result, the technique may have benefits for simulations in a statistical steady-state or otherwise showing temporal stability. These results suggest that while the model offers a computationally efficient alternative for datasets with temporal stability, its current formulation is best suited for interpolation rather than for predicting future states in time-evolving systems. This study thus lays the groundwork for further refinement of neural network-based approaches to low-rank matrix factorization in high-dimensional plasma simulations.

97 MATHEMATICS AND COMPUTING

Remote control circuit breaker evaluation testing

Engineering evaluation tests were performed on several models/types of remote control circuit breakers marketed in an attempt to gain some insight into their potential suitability for use on the space shuttle vehicle. Tests included the measurement of several electrical and operational performance parameters under laboratory ambient, space simulation, acceleration and vibration environmental conditions.

Bemko, L. M.

Evaluation report for toggle switches: Micro Switch and Cutler-Hammer models per MIL-S-3950

Several models of hermetically sealed toggle switches meeting the requirements of MIL-S-3950, were evaluated to determine the probability that they would withstand the environmental requirements of, and therefore be suitable for use on, the space shuttle vehicle. The evaluation was started with a comparison of the environmental requirements for space shuttle hardware. This was followed with in-house testing for those environments where a reasonably firm conclusion could not be drawn in the comparison. Space simulation, acceleration, and vibration testing were performed in-house.

Labberton, D.

Preliminary results of accelerated exposure testing of solar cell system components

Plastic samples and solar cell sub modules were exposed to an accelerated outdoor environment in Arizona and an accelerated simulated environment in a cyclic ultraviolet exposure tester which included humidity exposure. These tests were for preliminary screening of materials suitable for use in the manufacture of solar cell modules which are to have a 20-year lifetime. The samples were exposed for various times up to six months, equivalent to a real time exposure of four years. Suitable materials were found to be FEP-A, FEP-C, PFA, acrylic, silicone compounds and adhesives and possibly parylene. The method of packaging the sub modules was also found to be important to their performance.

Anagnostou, E.

Results of accelerated thermal cycle tests of solar cells modules

Various candidate solar panel designs were evaluated, both theoretically and experimentally, with respect to their thermal cycling survival capability, and in particular with respect to an accelerated simulation of thermal cycles representative of Viking '75 mission requirements. The experimental results were obtained on 'mini-panels' thermally cycled in a newly installed automated test facility herein described. The resulting damage was analyzed physically and theoretically, and on the basis of these analyses the panel design was suitably modified to significantly improve its ability to withstand the thermal environment. These successful modifications demonstrate the value of the complementary theoretical-experimental approach adopted, and discussed in detail in this paper.

Berman, P.

Preliminary Silver-hydrogen Cell Test Results

Silver-hydrogen cells were tested. The objective of the test was to estimate useful life by operation at accelerated, simulated geosynchronous orbit conditions. Ten simulated seasons were run and are summarized. The results to-date reflect stable, trouble-free performance and indicate that the silver-hydrogen couple shows promise as a lightweight alternative to the nickel systems.

Lurie, C.

Sensitivity to edge and flow rate in the control of speed and altitude

A number of studies have examined the potential efficacy of global flow rate and edge rate for specifying changes in self-motion. These have ranged from passive judgements of simulated accelerating self-motion to the active control of altitude in the presence of changes in flow and edge rates. A number of these studies are summarized and an attempt is made to reconcile their respective findings.

Wolpert, Lawrence

Summary of Rocketdyne Engine A5 Rocket Based Combined Cycle Testing

Rocketdyne Propulsion and Power (RPP) has completed a highly successful experimental test program of an advanced rocket based combined cycle (RBCC) propulsion system. The test program was conducted as part of the Advanced Reusable Technology program directed by NASA-MSFC to demonstrate technologies for low-cost access to space. Testing was conducted in the new GASL Flight Acceleration Simulation Test (FAST) facility at sea level (Mach 0), Mach 3.0 - 4.0, and vacuum flight conditions. Significant achievements obtained during the test program include 1) demonstration of engine operation in air-augmented rocket mode (AAR), ramjet mode and rocket mode and 2) smooth transition from AAR to ramjet mode operation. Testing in the fourth mode (scramjet) is scheduled for November 1998.

Ketchum. A.

Rocket-Based Combined Cycle Engine Concept Development

The development of rocket-based combined cycle (RBCC) propulsion systems is part of a 12 year effort under both company funding and contract work. The concept is a fixed geometry integrated rocket, ramjet, scramjet, which is hydrogen fueled and uses hydrogen regenerative cooling. The baseline engine structural configuration uses an integral structure that eliminates panel seals, seal purge gas, and closeout side attachments. Engine A5 is the current configuration for NASA Marshall Space Flight Center (MSFC) for the ART program. Engine A5 models the complete flight engine flowpath of inlet, isolator, airbreathing combustor, and nozzle. High-performance rocket thrusters are integrated into the engine enabling both low speed air-augmented rocket (AAR) and high speed pure rocket operation. Engine A5 was tested in GASL's new Flight Acceleration Simulation Test (FAST) facility in all four operating modes, AAR, RAM, SCRAM, and Rocket. Additionally, transition from AAR to RAM and RAM to SCRAM was also demonstrated. Measured performance demonstrated vision vehicle performance levels for Mach 3 AAR operation and ramjet operation from Mach 3 to 4. SCRAM and rocket mode performance was above predictions. For the first time, testing also demonstrated transition between operating modes.

Ratekin, G.

X-38 Bolt Retractor Subsystem Separation Demonstration

The Flight Robotics Laboratory FRL successfully demonstrated the X-38 bolt retractor subsystem (BRS). The BRS design was proven safe by testing in the Pyrotechnic Shock Facility (PSI) before being demonstrated in the FRL. This Technical Memorandum describes the BRS, FRL, PSF, and interface hardware. Bolt retraction time, spacecraft simulator acceleration, and a force analysis are also presented. The purpose of the demonstration was to show the FRL capability for spacecraft separation testing using pyrotechnics. Although a formal test was not performed due to schedule and budget constraints, the data will show that the BRS is a successful design concept and the FRL is suitable for future separation tests.

Rugless, Fedoria

A Control Allocation Technique to Recover From Pilot-Induced Oscillations (CAPIO) Due to Actuator Rate Limiting

This paper proposes a control allocation technique that can help pilots recover from pilot induced oscillations (PIO). When actuators are rate-saturated due to aggressive pilot commands, high gain flight control systems or some anomaly in the system, the effective delay in the control loop may increase depending on the nature of the cause. This effective delay increase manifests itself as a phase shift between the commanded and actual system signals and can instigate PIOs. The proposed control allocator reduces the effective time delay by minimizing the phase shift between the commanded and the actual attitude accelerations. Simulation results are reported, which demonstrate phase shift minimization and recovery from PIOs. Conversion of the objective function to be minimized and constraints to a form that is suitable for implementation is given.

Yildiz, Yildiray

A Model Study of the Impact of Source Gas Changes on the Stratosphere for 1850-2100

The long term stratospheric impacts due to emissions of CO2, CH4, N2O, and ozone depleting substances (ODSs) are investigated using an updated version of the Goddard two-dimensional (2D) model. Perturbation simulations with the ODSs, CO2, CH4, and N2O varied individually are performed to isolate the relative roles of these gases in driving stratospheric changes over the 1850-2100 time period. We also show comparisons with observations and the God- 40 dard Earth Observing System chemistry-climate model simulations for the time period 1970-2100 to illustrate that the 2D model captures the basic processes responsible for longterm stratospheric change. The 2D simulations indicate that prior to 1940, the 45 ozone increases due to CO2 and CH4 loading outpace the ozone losses due to increasing N2O and carbon tetrachloride (CCl4) emissions, so that ozone reaches a broad maximum during the 1920s-1930s. This preceeds the significant ozone depletion during approx. 1960-2050 driven by the ODS loading. During the latter half of the 21st century as ODS emissions diminish, CO2, N2O, and CH4 loading will all have significant impacts on global total ozone based on the IPCC AIB (medium) scenario, with CO2 having the largest individual effect. Sensitivity tests illustrate that due to the strong chemical interaction between methane and chlorine, the CH4 impact on total ozone becomes significantly more positive with larger ODS loading. The model simulations also show that changes in stratospheric temperature, Brewer-Dobson circulation (BDC), and age of air during 1850-2100 are controlled mainly by the CO2 and ODS loading. The simulated acceleration of the BDC causes the age of air to decrease by approx. 1 year from 1860-2100. The corresponding photochemical lifetimes of N2O, CFCl3, CF2Cl2, and CCl4 decrease by 11-13% during 1960-2100 due to the acceleration of the BDC, with much smaller lifetime changes 4%) caused by changes in the photochemical loss rates.

Fleming, E. L.

The Effect of Dose Rate on Composite Durability When Exposed to a Simulated Long-Term Lunar Radiation Environment

Human exploration of space beyond low Earth orbit (LEO) requires a safe living and working environment for crew. Composite materials are one type of material being investigated by NASA as a multi-functional structural approach to habitats for long-term use in space or on planetary surfaces with limited magnetic fields and atmosphere. These materials provide high strength with the potential for decreased weight and increased radiation protection of crew and electronics when compared with conventional aluminum structures. However, these materials have not been evaluated in a harsh radiation environment, as would be experienced outside of LEO or on a planetary surface. Thus, NASA has been investigating the durability of select composite materials in a long-term radiation environment. Previously, NASA exposed composite samples to a simulated, accelerated 30-year radiation treatment and tensile stresses similar to those of a habitat pressure vessel. The results showed evidence of potential surface oxidation and enhanced cross-linking of the matrix. As a follow-on study, we performed the same accelerated exposure alongside an exposure with a decreased dose rate. The slower dose ]rate is comparable to a realistic scenario, although still accelerated. Strain measurements were collected during exposure and showed that with a fastdose rate, the strain decreased with time, but with a slow ]dose rate, the strain increased with time. After the radiation exposures, samples were characterized via tensile tests, flexure tests, Fourier Transform Infrared Spectroscopy (FTIR), and Differential Scanning Calorimetry (DSC). The results of these tests will be discussed.

Rojdev, Kristina

Demonstration of a Pyrotechnic Bolt-Retractor System

A paper describes a demonstration of the X-38 bolt-retractor system (BRS) on a spacecraft-simulating apparatus, called the Large Mobility Base, in NASA's Flight Robotics Laboratory (FRL). The BRS design was proven safe by testing in NASA's Pyrotechnic Shock Facility (PSF) before being demonstrated in the FRL. The paper describes the BRS, FRL, PSF, and interface hardware. Information on the bolt-retraction time and spacecraft-simulator acceleration, and an analysis of forces, are presented. The purpose of the demonstration was to show the capability of the FRL for testing of the use of pyrotechnics to separate stages of a spacecraft. Although a formal test was not performed because of schedule and budget constraints, the data in the report show that the BRS is a successful design concept and the FRL is suitable for future separation tests.

Johnston, Nick

QSPIN: A High Level Java API for Quantum Computing Experimentation

QSPIN is a high level Java language API for experimentation in QC models used in the calculation of Ising spin glass ground states and related quadratic unconstrained binary optimization (QUBO) problems. The Java API is intended to facilitate research in advanced QC algorithms such as hybrid quantum-classical solvers, automatic selection of constraint and optimization parameters, and techniques for the correction and mitigation of model and solution errors. QSPIN includes high level solver objects tailored to the D-Wave quantum annealing architecture that implement hybrid quantum-classical algorithms [Booth et al.] for solving large problems on small quantum devices, elimination of variables via roof duality, and classical computing optimization methods such as GPU accelerated simulated annealing and tabu search for comparison. A test suite of documented NP-complete applications ranging from graph coloring, covering, and partitioning to integer programming and scheduling are provided to demonstrate current capabilities.

Quantu

High-Propellant Throughput Sub-kW Electric Propulsion System for Deep Space Science and Exploration

The National Aeronautics and Space Administration (NASA) is maturing high-propellant throughput sub-kilowatt electric propulsion technologies to enable small spacecraft deep space science and exploration missions with high delta-v requirements. The pathfinder model (PM) propulsion system consists of the H71M-PM Hall-effect thruster, a breadboard 1-kW power processing unit (PPU), and a propellant flow control system. The propulsion system requirements balance the needs of various high delta-v NASA and commercial industry mission concepts to achieve a design that both enables a variety of NASA small spacecraft deep space missions, while remaining viable for select commercial applications. The H71M-PM thruster has completed performance characterization and three 500-h short duration wear tests (SDWT). The propulsion system provides stable thrust generation over a wide range of operating conditions from 200 W to 1 kW, and 200 V to 400 V. The thruster has demonstrated a thrust as high as 68 mN at 300 V and 1 kW. The thruster has similarly demonstrated a specific impulse of 1850 s at 400 V and 1 kW. Key surfaces were machined between each SDWT to simulate accelerated discharge channel and pole cover erosion. Profilometry scans across masked pole cover surfaces were conducted to determine erosion rates. SDWT results support that a target thruster lifetime of 14 kh with 50% margin is achievable. Component testing has demonstrated propellant azimuthal flow uniformity better than ± 2 percent of the nominal value, azimuthal magnetic field uniformity better than ± 0.5 percent of the nominal value, and cathode heater cycle testing to greater than 30,000 cycles. Propulsion system integrated system testing is planned to use the H71M-PM and a breadboard 1-kW PPU. Pathfinder model test results are now supporting the design of the H71M-EM engineering model thruster. A second-generation breadboard PPU has been fabricated and is currently under test. NASA has made these technologies available to U.S. industry through a no cost, nonexclusive license agreement.

Hall