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At least 1,567 records · Page 87

Simulation of Ultra-Small MOSFETs Using a 2-D Quantum-Corrected Drift-Diffusion Model

We describe an electronic transport model and an implementation approach that respond to the challenges of device modeling for gigascale integration. We use the density-gradient (DG) transport model, which adds tunneling and quantum smoothing of carrier density profiles to the drift-diffusion model. We present the current implementation of the DG model in PROPHET, a partial differential equation solver developed by Lucent Technologies. This implementation approach permits rapid development and enhancement of models, as well as run-time modifications and model switching. We show that even in typical bulk transport devices such as P-N diodes and BJTs, DG quantum effects can significantly modify the I-V characteristics. Quantum effects are shown to be even more significant in small, surface transport devices, such as sub-0.1 micron MOSFETs. In thin-oxide MOS capacitors, we find that quantum effects may reduce gate capacitance by 25% or more. The inclusion of quantum effects in simulations dramatically improves the match between C-V simulations and measurements. Significant quantum corrections also occur in the I-V characteristics of short-channel MOSFETs due to the gate capacitance correction.

Biegel, Bryan A.↗

Enabling attractive-repulsive potentials in binary-collision-approximation monte-carlo codes for ion-surface interactions

Abstract Binary Collision Approximation (BCA) codes for ion-material interactions, such as SRIM, Tridyn, F-TRIDYN, and SDtrimSP, have historically been limited to screened Coulomb potentials even at low energies due to the difficulty in numerically solving the Distance of Closest Approach (DOCA) problem for attractive-repulsive potentials. Techniques such as direct n-body simulation or modifications to Newton’s method are either prohibitively costly or not guaranteed to work for all potentials. Advanced rootfinding techniques, such as companion matrix solvers, offer a solution. For many attractive-repulsive potentials, however, a companion matrix cannot be used directly, because there is no way to put the associated functions into a monomial basis form. A complementary technique is proxy rootfinding—by finding the best-fit polynomial approximant of a function, the zeros of the approximant can be guaranteed to be close to the zeros of the function. Using the Chebyshev basis and grid offers additional guarantees with regards to the quality of the approximation, the speed of convergence, and the avoidance of Runge’s phenomenon. By finding Chebyshev interpolants and using the Chebyshev-Frobenius companion matrix, the zeros of any real function on a bounded domain can be found. Here we show that using an Adaptive Chebyshev Proxy Rootfinder with Automatic Subdivision (ACPRAS) with appropriate scaling functions, numerical issues presented by attractive-repulsive potentials, including those of scale, can be handled. Using these techniques, we show that it is possible to include any physically reasonable interatomic potential in a BCA code, and to guarantee correctness of the resulting scattering angle calculations.

Materials Science↗

Diurnal Cycles in SST: Coupled Data Assimilation and Future Observational Requirements

Most operational centers are developing coupled (atmosphere-ocean) data assimilation systems as an alternative to uncoupled counterparts (atmosphere- or ocean-only). The Sea Surface Temperature (SST) is one of the key variables that tightly connects the atmosphere and ocean states and also air-sea fluxes. However, current prototype coupled data assimilation systems rely on external (L4) gridded SST or along-track (L3 or L2) SST retrievals as observed data or relaxation field. But in reality, SST are measurements are available from sparse in-situ network of ships, moorings, and buoys; all of them combined together are far less than those from satellites. However, satellites do not directly measure temperature, and inferring SST from satellite measured radiances requires a radiative transfer model, its calibration and also bias correction.The NASA Global Modeling and Assimilation Office (GMAO) is developing a coupled data assimilation system which assimilates SST directly from the raw observations, i.e., satellite radiances and in-situ observations. The methodology to directly assimilate radiances for SST became operational in Jan, 2017 in the GMAO's near-real time Weather Analysis and Prediction System. There were many modifications to the GMAO system in order to implement SST assimilation, most of which generally improved the predictability of the system. In order to maintain and further improve this system, we advocate for the availability of a microwave satellite radiometer in future beyond the currently operational GPM- GMI and AMSR-2 missions. For improved modeling of the near-surface temperature, salinity and mixing processes, we suggest adding more than one temperature sensor and salinity sensors to the drifting buoy network.

Akella, Santha↗

Optical Excitation of a Nanoparticle Cu/p-NiO Photocathode Improves Reaction Selectivity for CO 2 Reduction in Aqueous Electrolytes

We report the light-induced modification of catalytic selectivity for photoelectrochemical CO 2 reduction in aqueous media using copper (Cu) nanoparticles dispersed onto p-type nickel oxide (p-NiO) photocathodes. Optical excitation of Cu nanoparticles generates hot electrons available for driving CO 2 reduction on the Cu surface, while charge separation is accomplished by hot-hole injection from the Cu nanoparticles into the underlying p-NiO support. Photoelectrochemical studies demonstrate that optical excitation of plasmonic Cu/p-NiO photocathodes imparts increased selectivity for CO 2 reduction over hydrogen evolution in aqueous electrolytes. Specifically, we observed that plasmon-driven CO 2 reduction increased the production of carbon monoxide and formate, while simultaneously reducing the evolution of hydrogen. Our results demonstrate an optical route toward steering the selectivity of artificial photosynthetic systems with plasmon-driven photocathodes for photoelectrochemical CO 2 reduction in aqueous media.

25 ENERGY STORAGE↗

Coherent Erbium Spin Defects in Colloidal Nanocrystal Hosts

We demonstrate nearly a microsecond of spin coherence in Er 3+ ions doped in cerium dioxide nanocrystal hosts, despite a large gyromagnetic ratio and nanometric proximity of the spin defect to the nanocrystal surface. The long spin coherence is enabled by reducing the dopant density below the instantaneous diffusion limit in a nuclear spin-free host material, reaching the limit of a single erbium spin defect per nanocrystal. We observe a large Orbach energy in a highly symmetric cubic site, further protecting the coherence in a qubit that would otherwise rapidly decohere. Spatially correlated electron spectroscopy measurements reveal the presence of Ce 3+ at the nanocrystal surface, which likely acts as extraneous paramagnetic spin noise. Even with these factors, defect-embedded nanocrystal hosts show tremendous promise for quantum sensing and quantum communication applications, with multiple avenues, including core-shell fabrication, redox tuning of oxygen vacancies, and organic surfactant modification, available to further enhance their spin coherence and functionality in the future.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Engineered Water for Improved Oil Recovery from Fractured Reservoirs (Final Scientific/Technical Report)

The goal of this proposal is to field test the novel technology of engineered water (modifying ionic composition and/or adding surfactants or nanoparticles) injection to improve oil recovery from the carbonate matrix in fractured reservoirs. Carbonate reservoirs tend to be oil-wet/mixed-wet due to positively charged carbonate mineral surfaces and negatively charged acidic/asphaltic components in the oil. Many carbonate reservoirs are also highly fractured. Water injection does not work efficiently in fractured oil-wet reservoirs because water does not imbibe into the matrix. The water composition can be engineered with ionic modification, surfactants and nanoparticles which can change the wettability of carbonate rocks towards more water-wet conditions which can imbibe water into the matrix and push the oil into the fractures. The engineered water can also lower interfacial tension and minimize capillary forces so that gravity can push the oil up and out of the matrix. Wettability alteration also increases water relative permeability which can also improve oil recovery in non-fractured carbonate reservoirs. This technology, if successful, can be a game changer for West Texas carbonates.

02 PETROLEUM↗

Overview of the Instrumentation for the Dark Energy Spectroscopic Instrument

Abstract The Dark Energy Spectroscopic Instrument (DESI) embarked on an ambitious 5 yr survey in 2021 May to explore the nature of dark energy with spectroscopic measurements of 40 million galaxies and quasars. DESI will determine precise redshifts and employ the baryon acoustic oscillation method to measure distances from the nearby universe to beyond redshift z > 3.5, and employ redshift space distortions to measure the growth of structure and probe potential modifications to general relativity. We describe the significant instrumentation we developed to conduct the DESI survey. This includes: a wide-field, 3.°2 diameter prime-focus corrector; a focal plane system with 5020 fiber positioners on the 0.812 m diameter, aspheric focal surface; 10 continuous, high-efficiency fiber cable bundles that connect the focal plane to the spectrographs; and 10 identical spectrographs. Each spectrograph employs a pair of dichroics to split the light into three channels that together record the light from 360–980 nm with a spectral resolution that ranges from 2000–5000. We describe the science requirements, their connection to the technical requirements, the management of the project, and interfaces between subsystems. DESI was installed at the 4 m Mayall Telescope at Kitt Peak National Observatory and has achieved all of its performance goals. Some performance highlights include an rms positioner accuracy of better than 0.″1 and a median signal-to-noise ratio of 7 of the [O ii ] doublet at 8 × 10 −17 erg s −1 cm −2 in 1000 s for galaxies at z = 1.4–1.6. We conclude with additional highlights from the on-sky validation and commissioning, key successes, and lessons learned.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Towards an improved representation of carbonaceous aerosols over the Indian monsoon region in a regional climate model: RegCM

Mitigation of carbonaceous aerosol emissions is expected to provide climate and health co-benefits. The accurate representation of carbonaceous aerosols in climate models is critical for reducing uncertainties in their climate feedback. In this regard, emission fluxes and aerosol life cycle processes are the two primary sources of uncertainties. Here, we demonstrate that the incorporation of a dynamic ageing scheme and emission estimates that are updated for the local sources improves the representation of carbonaceous aerosols over the Indian monsoon region in a regional climate model, RegCM, compared with its default configuration. The respective mean black carbon (BC) and organic carbon (OC) surface concentrations in 2010 are estimated to be 4.25 and 10.35 µg m -3 over the Indo-Gangetic Plain (IGP) in the augmented model. The BC column burden over the polluted IGP is found to be 2.47 mg m -2 , 69.95 % higher than in the default model configuration and much closer to available observations. The anthropogenic aerosol optical depth (AOD) increases by more than 19 % over the IGP due to the model enhancement, also leading to a better agreement with observed AOD. The respective top-of-the-atmosphere, surface, and atmospheric anthropogenic aerosol short-wave radiative forcing are estimated at -0.3, -9.3, and 9.0 W m -2 over the IGP and -0.89, -5.33, and 4.44 W m -2 over Peninsular India (PI). Our results suggest that the combined effect of two modifications leads to maximum improvements in the model performance in regions where emissions play a dominant role.

54 ENVIRONMENTAL SCIENCES↗

Human health effects of ozone reduction

Modification of the stratosphere, such as a reduction in its equilibrium ozone content, could produce direct and indirect effects on human health. The direct hazard to humans would be caused by an increase in the cumulative amount of UV radiation reaching the earth's surface in the range of 285 to 340 nm, encompassing the UV-B or erythemal wavelength region of 280 to 320 nm. Exposing the susceptible human population to an increased total UV dosage of shorter wavelengths could increase skin cancer incidence. Although effects would be delayed by decades, for each 1% decrease in ozone the expected increase in skin cancer incidence would be on the order of 2%.

Source record↗

Mineralogy, petrology and chemistry of ANT-suite rocks from the lunar highlands

Anorthositic-noritic-troctolitic (ANT) rocks are the oldest and most abundant rocks of the lunar surface, and comprise about 90% of the suite of the lunar highlands. Consideration is given to the mineralogy, petrology, bulk chemistry, and origin of ANT-suite rocks. Problems associated in classifying and labeling lunar highland rocks because of textural complexities occurring from impact modifications are discussed. The mineralogy of ANT-suite rocks, dominated by plagioclase, olivine and pyrozene, and containing various minor minerals, is outlined. The petrology of ANT-suite rocks is reviewed along with the major element bulk composition of these rocks, noting that they are extremely depleted in K2O and P2O5. Various models describing the origin of ANT-suite rocks are summarized, and it is suggested that this origin involves a parental liquid of high-alumina basalt with low Fe/Fe+Mg.

Prinz, M.↗

Improvements in Heat Transfer for Anti-Icing of Gas-Heated Airfoils with Internal Fins and Partitions

The effect of modifying the gas passage of hollow metal airfoils by the additIon of internal fins and partitions was experimentally investigated and comparisons were made among a basic unfinned airfoil section and two airfoil designs having metal fins attached at the leading edge of the internal gas passage. An analysis considering the effects of heat conduction in the airfoil metal was made to determine the internal modification effectiveness that may be obtained in gas-heated components, such as turbojet-inlet guide vanes, support struts, hollow propeller blades, arid. thin wings. Over a wide range of heated-gas flow and tunnel-air velocity, the increase In surface-heating rates with internal finning was marked (up to 3.5 times), with the greatest increase occurring at the leading edge where anti-icing heat requirements are most critical. Variations in the amount and the location of internal finning and. partitioning provided. control over the local rates of surface heat transfer and permitted efficient anti-icing utilization of the gas-stream heat content.

Gray, Vernon H.↗

Juncture flow control using leading-edge fillets

Flow measurements have been made in the wake region of a simulated wing-fuselage juncture, with and without leading-edge fillets, in order to assess the effect of leading-edge modifications on the flow field around the juncture. Preliminary results indicate that there is some reduction in juncture drag at moderate angles of attack with the use of leading-edge fillets. There is also evidence of improvement in the flow characteristics on the surface downstream of the juncture when fillets are used. As the fillet size is increased, flow characteristics start deteriorating at some point, and an optimum fillet size may be required to achieve an overall improvement in the flow field.

Kubendran, L. R.↗

Nonlinear feedbacks between stratocumulus and synoptic-scale systems

The research progress for FY-91 is presented. Wintertime and springtime stratocumulus observations for a number of 5-day periods were collected. Close correlations between the mean 850 and 500 mb trough positions and cloud cover over marine areas were found. A linear study of the radiatively-driven interaction between stratocumulus and synoptic-scale waves was completed. Shallow surface-bound traveling waves are created that are strongly dependent on the phase relation between cloud and low-level flow. A nonlinear model is now under development that will permit a more detailed investigation of these interactions. Finally, a nonlinear study of the modifications of the background flow by boundary layer roll vortices was revised for submission for publication. The research plans for FY-92 are included.

Clark, John H. E.↗

Modelling, simulation and sounding of cometary nuclei; Proceedings of the International Workshop, Cagliari, Italy, May 28-30, 1991

The present workshop on the modeling, simulation, and sounding of cometary nuclei discusses the Rosetta comet-nucleus sample return mission, the importance of comet models in the design of the Rosetta mission, the challenge of sample acquisition in a cometary environment, and a simulation of Rosetta on-comet operations. Attention is given to HST observations of the inner coma of Comet Levy 1990c, cometary coma particulate modeling for the Rosetta mission aphelion rendezvous, recent gas flux modeling and applications of cometary nuclei, and the 3D time-dependent modeling of comet nucleus surface layers. Topics addressed include models of cometary nuclei and future space mission, the composition of cometary materials, experiments with cometary analogs at the DLR, and crust formation in cometary analogs. Also considered are gaseous products from VUV photolysis of cometary solids, cosmic ray modification of organic cometary matter as simulated by cyclotron irradiation, and KOSI comet simulation experiments.

Source record↗

Control of the Magellan spacecraft during aerobraking

In May 1993 the Magellan spacecraft will be lowered into the Venus atmosphere for the purpose of `aerobraking' to slow the spacecraft and achieve a near-circular orbit. The unprecedented science return of a 99% surface map, already accomplished by Magellan, will then be augmented by new atmospheric data and the opportunity to produce a high-resolution global gravity map from this circular orbit. The aerobraking concept, attitude control modeling and simulation results, and on-board software modifications are presented.

Carpenter, Anita S.↗

A Solar Reflectance Method for Retrieving Cloud Optical Thickness and Droplet Size Over Snow and Ice Surfaces

Cloud optical thickness and effective radius retrievals from solar reflectance measurements are traditionally implemented using a combination of spectral channels that are absorbing and non-absorbing for water particles. Reflectances in non-absorbing channels (e.g., 0.67, 0.86, 1.2 micron spectral window bands) are largely dependent on cloud optical thickness, while longer wavelength absorbing channels (1.6, 2. 1, and 3.7 micron window bands) provide cloud particle size information. Cloud retrievals over ice and snow surfaces present serious difficulties. At the shorter wavelengths, ice is bright and highly variable, both characteristics acting to significantly increase cloud retrieval uncertainty. In contrast, reflectances at the longer wavelengths are relatively small and may be comparable to that of dark open water. A modification to the traditional cloud retrieval technique is devised. The new algorithm uses only a combination of absorbing spectral channels for which the snow/ice albedo is relatively small. Using this approach, retrievals have been made with the MODIS Airborne Simulator (MAS) imager flown aboard the NASA ER-2 from May - June 1998 during the Arctic FIRE-ACE field deployment. Data from several coordinated ER-2 and University of Washington CV-580 in situ aircraft observations of liquid water stratus clouds are examined. MAS retrievals of optical thickness, droplet effective radius, and liquid water path are shown to be in good agreement with the in situ measurements. The initial success of the technique has implications for future operational satellite cloud retrieval algorithms in polar and wintertime regions.

Platnick, S.↗

GSRP/David Marshall: Fully Automated Cartesian Grid CFD Application for MDO in High Speed Flows

With the renewed interest in Cartesian gridding methodologies for the ease and speed of gridding complex geometries in addition to the simplicity of the control volumes used in the computations, it has become important to investigate ways of extending the existing Cartesian grid solver functionalities. This includes developing methods of modeling the viscous effects in order to utilize Cartesian grids solvers for accurate drag predictions and addressing the issues related to the distributed memory parallelization of Cartesian solvers. This research presents advances in two areas of interest in Cartesian grid solvers, viscous effects modeling and MPI parallelization. The development of viscous effects modeling using solely Cartesian grids has been hampered by the widely varying control volume sizes associated with the mesh refinement and the cut cells associated with the solid surface. This problem is being addressed by using physically based modeling techniques to update the state vectors of the cut cells and removing them from the finite volume integration scheme. This work is performed on a new Cartesian grid solver, NASCART-GT, with modifications to its cut cell functionality. The development of MPI parallelization addresses issues associated with utilizing Cartesian solvers on distributed memory parallel environments. This work is performed on an existing Cartesian grid solver, CART3D, with modifications to its parallelization methodology.

Source record↗

Oxidation and Associated Pore Structure Modification During Experimental Alteration of Granite

Weathering plays a crucial role in a number of environmental processes, and the microstructure and evolution of multi-scale pore space is a critically important factor in the weathering of geological formations. In igneous rocks the infiltration of meteoric water into initially relatively dry material can cause the rock to begin to disaggregate, increasing porosity and surface area, and allowing further disaggregation and weathering to occur. These processes, in turn, allow biota to colonize the rock, further enhancing the weathering rate. In some igneous rocks this may be driven by oxidation of primary minerals. One such mineral, biotite, has been repeatedly mentioned as a cause of cracking during oxidation. However, the scale-dependence of the processes by which this occurs are poorly understood. We cannot, therefore, accurately extrapolate laboratory reaction rates to the field in predictive numerical models. In order to better understand the effects of oxidation and test the hypothesis that fracture and disaggregation are initiated by swelling of oxidizing biotites, we reacted granite cores in a selenic acid-rich aqueous solution at 200°C for up to 438 days. Elevated temperatures and selenic acid were used to provide relatively fast reaction rates and highly oxidizing conditions in sealed reaction vessels. These experiments were analyzed using a combination of imaging, X-ray diffraction, Mössbauer spectroscopy, and small- and ultra-small angle neutron scattering to interrogate porosity and microfracture formation. The experimental results show little observable biotite swelling, but significant transport and growth of iron oxides and/or clays along grain boundaries throughout the sample. Significant increases in porosity were also observed at the sample rim, likely associated with feldspar alteration. Fractures and transport were observed throughout the core, suggesting that stresses due to crystallization pressures caused by the growing iron phases may be the initiating factors in granite weathering, possibly followed by biotite swelling after sufficient permeability is achieved.

Anovitz, Lawrence M.↗