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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 541 records · Page 30
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Quantum Computing Strategy 2026

Quantum computing (QC) is a rapidly maturing technology with the potential for revolutionary impacts on stockpile stewardship science and national security. Recent developments in fault-tolerant architectures have compressed vendor roadmaps, and predictions of a production-ready quantum computer by the mid-2030s are becoming increasingly credible. This strategy provides a roadmap for integrating QC into the Advanced Simulation and Computing (ASC) program by investing in four strategic focus areas: 1. Develop Capabilities in Mission-Relevant Quantum Applications: ASC will prioritize developing quantum-ready applications in mission areas that have shown significant promise for quantum advantage, including simulations of materials in extreme environments, nuclear dynamics, solving linear and nonlinear partial differential equations, and uncertainty quantification. These applications directly support stockpile stewardship science and modernization objectives. 2. Conduct R&D in Algorithms, Software, and Hardware: Sustained research into quantum algorithms, robust software tools, and quantum hardware is essential. ASC will develop efficient quantum algorithms; invest in quantum compilers, debuggers, and performance tools; and explore specialized quantum hardware tailored to NNSA’s unique requirements. 3. Engage with Vendors and Partners: Early and active collaboration with commercial quantum hardware vendors and academic partners is critical. Through testbeds, co-design agreements, and quantum demonstration facilities, ASC will influence hardware design, gain early access to emerging technologies, and ensure that quantum platforms evolve to meet mission needs. 4. Build Knowledge, Experience, and Workforce: Expanding and upskilling the quantum-trained workforce is essential to long-term success. This includes hiring, internal training, university outreach, and postdoctoral support to ensure ASC maintains the expertise required to operate, program, and integrate quantum systems as they become available. While quantum computing will never replace classical computing, it has the potential to solve certain problems with speed and accuracy that would be unachievable using any conceivable classical high-performance computing (HPC) system. By investing strategically in QC, ASC will help propel the emergent QC industry, maintain U.S. technological leadership, ensure mission readiness, and position itself to rapidly adopt quantum technologies as they mature.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2025

Bridging the length scales in ionic separations via data-driving machine learning

We pursued a data science driven machine learning (ML) approach that blended molecular scale attributes informed from molecular dynamics (MD) simulation and materials properties to the selectivity and energy efficiency in targeted ionic separations using electric fields. The model mixtures investigated for ionic separations are pH sensitive and include organic acids, silica and boron, transition metals, such as copper and chromium. There were two major research thrusts of this project. Firstly, we investigated surrogate models and deep learning that relate material chemistries and structures to selective transport of ionic species under applied electric fields. Secondly we investigated how the bipolar junction interfacial design and water dissociation catalyst in bipolar membranes affect reverse bias polarization behavior and pH modulation in deionization platforms as a function of the platform operating parameters (e.g., cell voltage, residence time, and salt feed concentration). As a result of this work, we also were able to start a new direction, namely ML models for molecular design of surfactants.

36 MATERIALS SCIENCE↗
NASA NTRS1966

High intensity radiation heat source is capable of sustained operation

Water cooled, high intensity radiation source rated at 125 kw, with an efficiency of 31 to 34 percent is used in the evaluation of ablative materials under simulated conditions of high velocity entry into planetary atmospheres. The source operates repeatedly at maximum power for periods of 10 to 20 minutes.

Geideman, W. A.↗
NASA NTRS1974

Thermophysical properties of lunar media. II - Heat transfer within the lunar surface layer

Heat transfer within the lunar surface layer depends on several thermophysical properties of the lunar regolith, including the thermal conductivity, the specific heat, the thermal diffusivity, and the thermal parameter. Results of property measurements on simulated lunar materials are presented where appropriate as well as measurements made on the actual samples themselves. The variation of temperature on the moon with depth is considered, taking into account various times of the lunar day. The daily variation in temperature drops to about 1 deg at a depth of only 0.172 meters. The steady temperature on the moon below this depth is 225 K.

Cremers, C. J.↗
NASA NTRS1977

Application of diffusion barriers to high modulus fibers

Barrier layers were coated onto high-modulus fibers, and nickel and titanium layers were overcoated as simulated matrix materials. The objective was to coat the high-strength fibers with unreactive selected materials without degrading the fibers. The fibers were tungsten, niobium, and single-crystal sapphire, while the materials used as barrier coating layers were Al2O3, Y2O3, TiC, ZrC, WC with 14% Co, and HfO2. An ion-plating technique was used to coat the fibers. The fibers were subjected to high-temperature heat treatments to evaluate the effectiveness of the barrier layer in preventing fiber-metal interactions. Results indicate that Al2O3, Y2O3, and HfO2 can be used as barrier layers to minimize the nickel-tungsten interaction. Further investigation, including thermal cycling tests at 1090 C, revealed that HfO2 is probably the best of the three.

Veltri, R. D.↗
NASA NTRS1977

Proceedings of the Spacecraft Charging Technology Conference: Executive Summary

Aerospace environments are reviewed in reference to spacecraft charging. Modelling, a theoretical scheme which can be used to describe the structure of the sheath around the spacecraft and to calculate the charging currents within, is discussed. Materials characterization is considered for experimental determination of the behavior of typical spacecraft materials when exposed to simulated geomagnetic substorm conditions. Materials development is also examined for controlling and minimizing spacecraft charging or at least for distributing the charge in an equipotential manner, using electrical conductive surfaces for materials exposed to space environment.

Pike, C. P.↗
NASA NTRS1976

Simulation of a cometary conglomerate of frozen gases and dust in a zero-gravity environment: A critical evaluation of possible space experiments

It is proposed to use the Shuttle (OFT experiments) or eventually Spacelab to study, in the absence of gravity the low velocity accretion and the bulk properties of icy conglomerates simulating cometary material and their sedimentation and bulk properties in very small acceleration fields. Their behavior when exposed to the direct solar flux is also under consideration.

Delsemme, A. H.↗
NASA NTRS1980

Distribution and source of the UV absorption in Venus' atmosphere

The model predictions were compared with the Pioneer Venus probes and orbiter to determine the composition of the UV absorbing materials. The simulations were carried out with radiative transfer codes which included spacecraft constraints on the aerosol and gas characteristics in the Venus atmosphere; gaseous SO2 (a source of opacity at the wavelengths below 0.32 microns), and a second absorber (which dominates above 0.32 microns) were required. The UV contrast variations are due to the optical depth changes in the upper haze layer producing brightness variations between equatorial and polar areas, and to differences in the depth over which the second UV absorber is depleted in the highest portion of the main clouds.

Pollack, J. B.↗
NASA NTRS1983

Effects of long duration exposure to simulated space environment on nonmetallic materials properties

Nonmetallic materials specimens from the Viking program were tested in situ invacuo after continuous thermal vacuum exposure from 1971/1972 to the present. Eleven tests were done on appropriate specimens of 30 materials; however, no single material received all the tests. Some specimens also were exposed to 1 or 2.5 MeV electrons at differing fluences before testing. Baseline exposure data is reported for graphite/epoxy specimens that were exposed to vacuum since 1974. These materials were transferred to the thermal vacuum storage facility for future in situ testing and irradiation. Thin G/E specimens were tensile tested after thermal-vacuum cycling exposure. Photomicrographic examinations and SEM analyses were done on the failed specimens.

Peacock, C. L., Jr.↗
NASA NTRS1985

Simulation studies for surfaces and materials strength

From intermolecular force studies, it is now known that the overall non-additive contribution to the lattice enegy is positive so that analysis based on only pairwise additivity suggests a shallower intermolecular potential than the true value. Two body contributions alone are also known to be categorically unable to even qualitatively describe some configurations of molecular clusters in the gas phase or the general relaxation and reconstruction of fcc crystal surfaces. In addition, the many-body contribution was shown to play a key role in the stability of certain crystal structures. In these recent analyses, a relatively simple potential energy function (PEF), comprising only a two-body Mie-type potential plus a three-body Axilrod-Teller-type potential, was found to be extremely effective. This same parametric PEF is applied to describe the bulk stability and surface energy for the diamond cubic structure. To test the stability condition, the FCC, BCC, diamond cubic, graphite and beta-tin structures were considered.

Halicioglu, T.↗
NASA NTRS1987

The loss and depth of CO2 ice in comet nuclei

An analytical model was developed to simulate the material differentiation of a cometary nucleus composed of water ice, putative unclathrated CO2 ice and silicate dust in specified proportions. Selective sublimation of any free CO2 ice present in a comet would produce a surface layer of water ice and dust overlying the original CO2 rich material. This surface layer reduces the temperature of buried CO2 ice and restricts the outflow of gaseous CO2. On each orbit, water sublimation at smaller heliocentric distances temporarily reduces the thickness of the water ice and dust layer and liberates dust. The model includes the effects of nucleus rotation, arbitrary orientation of the rotation axis, latitude, heat conduction into the deep interior of the nucleus and restriction of CO2 gas outflow by the water ice and dust layer. The effects of the permeability of the surface water ice layer, the nucleus rotation rate, and the latitude were investigated. Comparison of these and similar results with observations could yield information regarding the permeability and chemical composition of cometary material and suggest sampling strategies to minimize fractionation effects.

Fanale, F. P.↗