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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 703 records · Page 39
All sourcesNASA NTRSDOE OSTI
DOE OSTI2013

Cementitious Barriers Partnership (CBP): Using the CBP Software Toolbox to Simulate Sulfate Attack and Carbonation of Concrete Structures - 13481

The Cementitious Barriers Partnership (CBP) Project is a multi-disciplinary, multi-institutional collaboration supported by the U.S. Department of Energy Office of Tank Waste Management. The CBP project has developed a set of integrated modeling tools and leaching test methods to help improve understanding and prediction of the long-term hydraulic and chemical performance of cementitious materials used in nuclear applications. State-of-the-art modeling tools, including LeachXS{sup TM}/ORCHESTRA and STADIUM{sup R}, were selected for their demonstrated abilities to simulate reactive transport and degradation in cementitious materials. The new U.S. Environmental Protection Agency leaching test methods based on the Leaching Environmental Assessment Framework (LEAF), now adopted as part of the SW-846 RCRA methods, have been used to help make the link between modeling and experiment. Although each of the CBP tools has demonstrated utility as a standalone product, coupling the models over relevant spatial and temporal solution domains can provide more accurate predictions of cementitious materials behavior over relevant periods of performance. The LeachXS{sup TM}/ORCHESTRA and STADIUM{sup R} models were first linked to the GoldSim Monte Carlo simulator to better and more easily characterize model uncertainties and as a means to coupling the models allowing linking to broader performance assessment evaluations that use CBP results for a source term. Two important degradation scenarios were selected for initial demonstration: sulfate ingress / attack and carbonation of cementitious materials. When sufficient sulfate is present in the pore solution external to a concrete barrier, sulfate can diffuse into the concrete, react with the concrete solid phases, and cause cracking that significantly changes the transport and structural properties of the concrete. The penetration of gaseous carbon dioxide within partially saturated concrete usually initiates a series of carbonation reactions with both dissolved ions and the hydrated cement paste. The carbonation process itself does not have a negative effect, per se, on the paste physical properties and can even result in reduced porosity and can help form a protective layer at the surface of concrete. However, carbonation has been shown to increase leaching of some constituents and can potentially have a detrimental effect on reinforced concrete structures by lowering pH to ca. 9 and de-passivating embedded steel (e.g. rebar) and accelerating corrosion, which are important processes related to high-level waste tank integrity and closure evaluations. The use of the CBP Software Toolbox to simulate these important degradation phenomena for both concrete vaults and high-level waste tanks are demonstrated in this paper. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2016

Investigation of nuclear graphite emissivity behaviors at various temperatures and oxidation degrees - 18763

Air Ingress into the primary loop is generally considered as one of the most likely severe accidents that could occur in High Temperature Gas-cooled Reactors (HTGRs). With air ingress, the graphite materials would be oxidized resulting in decreased graphite structure strength and release of harmful gases. As the main passive heat transfer mechanism during air ingress, heat transfer by radiation has high efficiency due to high temperature fuels in HTGRs. However, it is found that oxidation of fuel cladding affects the radiation heat transfer of graphite components. The purpose of the current study is to propose an empirical model that predicts the normal spectral emissivity ({lambda}=1.55 {mu}m) of the IG-110 at various temperatures and oxidation degrees. In this study, the emissivities of IG-110 at 0.0 burn-off, 4.44% burn-off and 8.90% burn-off were measured by employing IR thermometer and K-type thermocouples at four different temperatures corresponding to 600 deg. C, 700 deg. C, 800 deg. C and 900 deg. C. An empirical model of the spectral emissivity as a function of temperature and oxidation degree was proposed and validated against experimental data. In addition, the emissivity measurements revealed that, during air ingress, HTGRs would experience degraded radiating heat transfer due to graphite oxidation over certain temperature range. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2018

A Biophysical Perspective on Enzyme Catalysis

According to the article, even after a century of investigation, our understanding of how enzymes work remains far from complete. In particular, several factors that enable enzymes to achieve high catalytic efficiencies remain only poorly understood. A number of theories have been developed, which propose or reaffirm that enzymes work as structural scaffolds, serving to bring together and properly orient the participants so that the reaction can proceed; therefore, leading to enzymes being viewed as only passive participants in the catalyzed reaction. A growing body of evidence shows that enzymes are not rigid structures but are constantly undergoing a wide range of internal motions and conformational fluctuations. In this Perspective, on the basis of studies from our group, we discuss the emerging biophysical model of enzyme catalysis that provides a detailed understanding of the interconnection among internal protein motions, conformational substates, enzyme mechanisms, and the catalytic efficiency of enzymes. For a number of enzymes, networks of conserved residues that extend from the surface of the enzyme all the way to the active site have been discovered. These networks are hypothesized to serve as pathways of energy transfer that enables thermodynamical coupling of the surrounding solvent with enzyme catalysis and play a role in promoting enzyme function. Additionally, the role of enzyme structure and electrostatic effects has been well acknowledged for quite some time. Collectively, the recent knowledge gained about enzyme mechanisms suggests that the conventional paradigm of enzyme structure encoding function is incomplete and needs to be extended to structure encodes dynamics, and together these enzyme features encode function including catalytic rate acceleration.

Biochemistry & Molecular Biology↗
NASA NTRS1986

The large deployable reflector: A NASA submillimeter-infrared orbiting observatory

The Large Deployable Reflector (LDR) concept is outlined. The LDR telescope is based on a 20-m diameter reflector. The primary mirror is a filled aperture made up of 84 hexagonal panels, each 2 m edge-to-edge. The panels are based on lightweight structural composite materials. The optical configuration is a four mirror two stage system. The primary mirror is passive. The active optical elements for figure control are at the quaternary mirror. The primary mirror panels are supported by a deployable PAC truss backup structure at the vertices of each hexagon. The four focal plane instruments covering the range of 30 to 1000 microns are located near the vertex of the primary mirror. Some instruments will be cooled with stored cryogens to liquid helium temperatures, others to liquid nitrogen temperatures. The spacecraft functions will be located in a resource module behind the primary mirror. The LDR will be transferred to orbit by the space transportation system and assembled and tested at the space station. It will then be boosted to an orbit of greater than or = 700 km as a free flyer.

Swanson, Paul N.↗
NASA NTRS2002

Mesospheric Temperature Structure during the GUARA Campaign and Comparison with the DROPPS and MaCWAVE Campaigns

A significant number of passive inflatable falling spheres launched from Alcantara, Brazil (2S) during the MALTED campaign in August 1994 showed unusual temperature layering at 70 and 85 km, Reprocessing of the original radar position data reveal more consistent temperature inversions over time than was observed during the DROPPS campaign conducted from northern Scandinavia during July 1999. Comparison between falling sphere measurements and the HALOE instrument on UARS provides a now perspective about the atmospheric structure at two widely separated locations. The availability of NASA and Brazilian C-band radars established high confidence in the data quality during MALTED. A new campaign, MaCWAVE scheduled this summer from Andoys, Rocket Range, Norway (67N) will provide characteristics of gravity wave activity that will be compared with the MALTED temperature and wind profiles.

Schmidlin, F. J.↗
DOE OSTI2017

High-efficiency selective boron emitter formed by wet chemical etch-back for n -type screen-printed Si solar cells

Front metal contact induced recombination and resistance are major efficiency limiting factors of large-area screen-printed n-type front junction Si solar cells with homogeneous emitter and tunnel oxide passivated back contact (TOPCON). Here, this paper shows the development of a selective boron emitter (p + /p ++ ) formed by a screen-printed resist masking and wet chemical etch-back process, which first grows a porous Si layer and subsequently removes it. Various wet-chemical solutions for forming porous Si layer are investigated. An industrial compatible process with sodium nitrite (NaNO 2 ) catalyst is developed to uniformly etch-back the ~47 Ω/ atmospheric pressure chemical vapor deposited heavily doped boron emitter to ~135 Ω/ by growing a 320 nm porous Si layer within 3 min and subsequently removing it. After etching back, the boron emitter was subjected to a thermal oxidation to lower the surface concentration and the emitter saturation current density J 0e . Various etched-back emitters were evaluated by measuring J 0e on symmetric test structures with atomic layer deposited aluminum oxide (Al 2 O 3 ) passivation. Very low J 0e of 21, 14, and 9 fA/cm 2 were obtained for the 120, 150, and 180 Ω/ etched-back emitters, respectively. A solar cell with a selective emitter (65/180 Ω/ ) formed by this etch-back technology and with an Al/Ag contact on the front and TOPCON on the back gave an open-circuit voltage (V oc ) of 682.8 mV and efficiency of 21.04% on n-type Czochralski Si wafer. Finally, this demonstrates the potential of this technology for next generation high-efficiency industrial n-type Si solar cells.

14 SOLAR ENERGY↗
DOE OSTI2018

Effect of Chemical Treatment of a Silicon Surface on the Quality and Structure of Silicon-Carbide Epitaxial Films Synthesized by Atom Substitution

The fundamentals of a new technique for the cleaning and passivation of (111), (110), and (100) silicon wafer surfaces by hydride groups, which ensure a high surface purity and smoothness at the nanoscale upon long-term storage of the wafers at room temperature in air, are discussed. A new composition of the passivation solution for the long-term antioxidation protection of silicon surfaces is developed. The proposed solution is suitable for the long-term storage and repeated passivation of silicon wafers. The composition of the passivation solution and the conditions of passivation of the silicon wafers in it are described. Silicon wafers treated using the proposed technique can be used for growing epitaxial semiconductor films and different nanostructures. It is shown that only silicon surfaces prepared in this way allow SiC epitaxial films on silicon to be grown by atom substitution. The experimental dependences of the SiC and GaN film structures grown on silicon on the silicon-surface etching conditions are presented. The developed technique for silicon cleaning and passivation can both be used under laboratory conditions and easily adapted for the industrial production of silicon wafers with an oxidation-resistant surface coating.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Methodological guidelines on concrete degradation based on predictive models and the release of MOSAIC for industry use

In light-water reactors (LWRs), the concrete biological shield (CBS) designates the concrete structure directly facing the reactor pressure vessel (RPV). The primary function of the CBS is to protect equipment and personnel from the neutron and gamma radiation exiting the RPV. Most CBSs in operation in the United States also provide structural support to the RPV. Based on a long-term structural analysis, the structural integrity of the CBS to transfer the in-service passive load to the foundation, dynamic loading during an earthquake, and thermal loading during a loss-of-coolant accident (LOCA) must be maintained. Based on test reactor data for accelerated conditions, the mechanical properties of irradiated concrete are affected when exposed to neutron fluence higher than ≈ 10 19 n.cm -2 (E > 0.1 MeV). At 80 years of operation, the fluence estimates at the surface of the CBS range between 1×10 19 and 7×10 19 n.cm -2 (E > 0.1 MeV): the fluence value depends mostly on the design. Although fluence attenuates through the CBS by virtue of the shielding properties of concrete, about 5% to 10% of the CBS wall depth is affected by high fluence. The main degradation mechanism is the so-called radiation-induced volumetric expansion (RIVE) caused by the amorphization of aggregate-forming minerals. RIVE causes large deformation of up to 18% in pure quartz, and it also reduces the structural properties of concrete. The structural effects of long-term exposure to fast neutron irradiation in LWRs was studied in the report entitled “Assessment of the Effect of the Irradiation-Induced Degradation on the In-Service Structural Performance of the Concrete Biological Shields” (M3LW-23OR0403013). This report illustrates that (1) irradiation-induced damage expands further than the region subject to a cumulative fluence of 10 19 n.cm -2 (E > 0.1 MeV) to reach the steel reinforcement location, and (2) the irradiation-induced damage region shows no substantial residual bearing capacity and should not be accounted for in the integrity assessment of the CBS.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2022

Enhanced Surface Passivation by Atomic Layer Deposited Al 2 O 3 for Ultraviolet Sensitive Silicon Photomultipliers

Here, we describe a superior passivation of p-type (p + ) Si surface by Al 2 O 3 thin film that is synthesized by plasma-assisted atomic layer deposition for ultraviolet sensitive silicon photomultipliers (SiPM), compared to conventional SiO 2 and SiN x passivation schemes. The superiority of Al 2 O 3 passivation is due to not only a sufficiently low interface defect density but also a high density of built-in negative charges. A 7 nm thin Al 2 O 3 film can yield an emitter saturation current density of ~8 fA/cm 2 on high sheet resistance p + layer, compared to ~60 and ~1480 fA/cm 2 for thermal SiO 2 and SiN x passivation. This superior surface passivation allows the photon-generated carriers to have higher probabilities to reach the high-field region to trigger an avalanche event. In addition, Al 2 O 3 thin film provides very low values of effective surface recombination velocity on low resistivity n-type and p-type Si surfaces, which can lead to well-passivated surface features on guard ring and trench isolation regions of SiPM. These demonstrate the potential of Al 2 O 3 thin film passivation to improve quantum efficiency and thus photo-detection efficiency of ultraviolet sensitive SiPM with p + /n - /n/n + structure.

36 MATERIALS SCIENCE↗
NASA NTRS1986

A study of tectonic activity in the Basin-Range Province and on the San Andreas Fault. No. 2: Lithospheric structure, seismicity, and contemporary deformation of the United States Cordillera

The structural evolution of the U.S. Cordillera has been influenced by a variety of tectonic mechanisms including passive margin rifting and sedimentation; arc volcanism; accretion of exotic terranes; intraplate magmatism; and folding and faulting associated with compression and extension processes that have profoundly influenced the lithospheric structure. As a result the Cordilleran crust is laterally inhomogeneous across its 2000 km east-west breadth. It is thin along the West Coast where it has close oceanic affinities. The crust thickens eastward beneath the Sierra Nevada, then thins beneath the Basin-Range. Crustal thickening continues eastward beneath the Colorado Plateau, the Rocky Mountains, and the Great Plains. The total lithospheric thickness attains 65 km in the Basin-Range and increases eastward beneath the Colorado Plateau. The upper-crust, including the crystalline basement of the Cordillera, has P sub G velocities of 6 km/s in the Basin-Range and Rio Grande Rift. Lower P sub G velocities of 5.4 to 5.7 km/s are associated with the youthful Yellowstone, Valles and Long Valley calderas and the Franciscan assemblage of the western coastal margin. Averaged crustal velocity reflects integrated tectonic evolution of the crust-thick silicic bodies, velocity reversals, and a thin crust produce low averaged velocities that are characteristic of a highly attenuated and thermally deformed crust.

Smith, R. B.↗
DOE OSTI2014

Thermal stability of photovoltaic a-Si:H determined by neutron reflectometry

Neutron and X-ray reflectometry were used to determine the layer structure and hydrogen content of thin films of amorphous silicon (a-Si:H) deposited onto crystalline silicon (Si) wafers for surface passivation in solar cells. The combination of these two reflectometry techniques is well suited for non-destructive probing of the structure of a-Si:H due to being able to probe buried interfaces and having sub-nanometer resolution. Neutron reflectometry is also unique in its ability to allow determination of density gradients of light elements such as hydrogen (H). The neutron scattering contrast between Si and H is strong, making it possible to determine the H concentration in the deposited a-Si:H. In order to correlate the surface passivation properties supplied by the a-Si:H thin films, as quantified by obtainable effective minority carrier lifetime, photoconductance measurements were also performed. It is shown that the minority carrier lifetime falls sharply when H has been desorbed from a-Si:H by annealing.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Luminescence mechanism in hydrogenated silicon quantum dots with a single oxygen ligand

Though photoluminescence (PL) of Si quantum dots (QDs) has been known for decades and both theoretical and experimental studies have been extensive, their luminescence mechanism has not been elaborated. Several models have been proposed to explain the mechanism. A deep insight into the origin of light emissions in Si QDs is necessary. This work calculated the ground- and excited state properties of hydrogenated Si QDs with various diameters, including full hydrogen passivation, single Si=O ligands, single epoxide and coexisting Si=O and epoxide structures in order to investigate the dominant contribution states for luminescence. The results revealed that even a single oxygen atom in hydrogenated Si QDs can dramatically change their electronic and optical properties. Intriguingly, we found that a size-independent emission, the strongest among all possible emissions, was induced by the single Si=O passivated Si-QDs. In non-oxidized Si-QDs exhibiting a core-related size-tunable emission, the luminescence properties can be modulated by the ligands of Si QDs, and a very small number of oxygen ligands can strongly influence the luminescence of nanocrystalline silicon. Our findings deepen the understanding of the PL mechanism of Si QDs and can further promote the development of silicon-based optoelectronic devices.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
NASA NTRS1992

Optimization methods for passive damper placement and tuning

The effectiveness of viscous elements in introducing damping in a structure is a function of several variables, including their number, their location in the structure, and their physical properties. In this paper several optimization problems are posed to optimize these variables. The paper investigates various metrics to define the optimization problem, and compares the damping profiles that are obtained. Both discrete and continuous optimization problems are formulated and solved, corresponding, respectively, to the problems of placement of damping elements and to the tuning of their parameters. The paper particularly emphasizes techniques to make feasible the large scale problems resulting from the optimization formulations. Numerical results involving a lightly damped tested structure are presented.

Milman, M. H.↗
NASA NTRS1994

Optimizaton Methods for Passive Damper Placement and Tunin

The effectiveness of viscous elements in introducing damping in a structure is a function of several variables, including their number, their location in the structure, and their physical properties. This paper addresses the questions of the placement of these elements and the selection of their physical parameters via optimization techniques.

viscous elements↗
DOE OSTI2019

Passivation of Germanium by Graphene for Stable Graphene/Germanium Heterostructure Devices

The scalable integration of graphene onto semiconductor platforms is an important step towards utilizing the exceptional structural, electronic, thermal, and mechanical properties of graphene in state-of-the-art technologies. Specifically, graphene films grown on Ge are an exciting materials system for high-performance electronics; however, the device performance depends sensitively on the structural, electronic, and chemical nature of the graphene/Ge interface. We have recently discovered that graphene grown directly on Ge via chemical vapor deposition (CVD) can passivate the Ge surface, preventing its oxidation for months—longer than alternate passivation methods reported in the literature. Yet, the factors that govern passivation are not understood. Here, we elucidate how the CVD growth conditions and Ge surface orientation affect Ge oxidation below graphene. We find that growing graphene with a high H2:CH4 flux ratio minimizes formation of defects in graphene, enhancing Ge passivation. While minimizing defects is important, surprisingly, we find that passivation depends much stronger on the Ge surface orientation. These results provide a route for the integration of graphene films with a pristine graphene/substrate interface on Ge, an important step towards stabilizing the Ge surface and realizing graphene-based or hybrid graphene/Ge heterostructure devices integrated directly on conventional semiconductor wafers.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2022

Structure and Fc-Effector Function of Rhesusized Variants of Human Anti-HIV-1 IgG1s

Passive transfer of monoclonal antibodies (mAbs) of human origin into Non-Human Primates (NHPs), especially those which function predominantly by a Fc-effector mechanism, requires an a priori preparation step, in which the human mAb is reengineered to an equivalent NHP IgG subclass. This can be achieved by changing both the Fc and Fab sequence while simultaneously maintaining the epitope specificity of the parent antibody. This Ab reengineering process, referred to as rhesusization, can be challenging because the simple grafting of the complementarity determining regions (CDRs) into an NHP IgG subclass may impact the functionality of the mAb. Here we describe the successful rhesusization of a set of human mAbs targeting HIV-1 envelope (Env) epitopes involved in potent Fc-effector function against the virus. This set includes a mAb targeting a linear gp120 V1V2 epitope isolated from a RV144 vaccinee, a gp120 conformational epitope within the Cluster A region isolated from a RV305 vaccinated individual, and a linear gp41 epitope within the immunodominant Cys-loop region commonly targeted by most HIV-1 infected individuals. Structural analyses confirm that the rhesusized variants bind their respective Env antigens with almost identical specificity preserving epitope footprints and most antigen-Fab atomic contacts with constant regions folded as in control RM IgG1s. In addition, functional analyses confirm preservation of the Fc effector function of the rhesusized mAbs including the ability to mediate Antibody Dependent Cell-mediated Cytotoxicity (ADCC) and antibody dependent cellular phagocytosis by monocytes (ADCP) and neutrophils (ADNP) with potencies comparable to native macaque antibodies of similar specificity. While the antibodies chosen here are relevant for the examination of the correlates of protection in HIV-1 vaccine trials, the methods used are generally applicable to antibodies for other purposes.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2015

Prediction of subsurface fracture in mining zone of Papua using passive seismic tomography based on Fresnel zone

Fracture prediction in a block cave of underground mine is very important to monitor the structure of the fracture that can be harmful to the mining activities. Many methods can be used to obtain such information, such as TDR (Time Domain Relectometry) and open hole. Both of them have limitations in range measurement. Passive seismic tomography is one of the subsurface imaging method. It has advantage in terms of measurements, cost, and rich of rock physical information. This passive seismic tomography studies using Fresnel zone to model the wavepath by using frequency parameter. Fresnel zone was developed by Nurhandoko in 2000. The result of this study is tomography of P and S wave velocity which can predict position of fracture. The study also attempted to use sum of the wavefronts to obtain position and time of seismic event occurence. Fresnel zone tomography and the summation wavefront can predict location of geological structure of mine area as well.

58 GEOSCIENCES↗
DOE OSTI2025

Measurement of Contact Resistivity In Symmetric Polycrystalline Si/SiO x /Monocrystalline Si Test Structures Using Variable Light Illumination

While different methods exist to determine the contact resistivity in semiconductor devices, these methods are limited to measurement of the majority carrier contacts. The measurement of p‐ or n‐type contacts on n‐ or p‐type crystalline silicon, respectively, is challenging due to the blocking diode formed by the p–n junction. In this article, we address this problem for tunneling oxide passivating contacts used in high‐efficiency Si solar cells. We propose a universal method to extract contact resistivity on symmetric test structures with polycrystalline silicon on SiO x (poly‐Si/SiO x ) passivating contacts under illumination, both for p–n and high–low‐junction passivated contacts. In this method, we demonstrate that the total contact resistance of each cell grid finger to the base wafer is governed by its effective contact area, defined by the transfer length extending from both sides of the finger. Therefore, the grid contact resistance of a poly‐Si contact depends on the ratio of the doped poly‐Si sheet resistance to the tunneling contact resistivity.

14 SOLAR ENERGY↗