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At least 973 records · Page 54

Formation Of the Giant Planets By Concurrent Accretion Of Solids And Gas

New numerical simulations of the formation of the giant planets are presented, in which for the first time both the gas and planetesimal accretion rates are calculated in a self-consistent, interactive fashion. The simulations combine three elements: 1) three-body accretion cross-sections of solids onto an isolated planetary embryo, 2) a stellar evolution code for the planet's gaseous envelope, and 3) a planetesimal dissolution code within the envelope, used to evaluate the planet's effective capture radius and the energy deposition profile of accreted material. Major assumptions include: The planet is embedded in a disk of gas and small planetesimals with locally uniform initial surface mass density, and planetesimals are not allowed to migrate into or out of the planet's feeding zone. All simulations are characterized by three major phases. During the first phase, the planet's mass consists primarily of solid material. The planetesimal accretion rate, which dominates that of gas, rapidly increases owing to runaway accretion, then decreases as the planet's feeding zone is depleted. During the second phase, both solid and gas accretion rates are small and nearly independent of time. The third phase, marked by runaway gas accretion, starts when the solid and gas masses are about equal. It is engendered by a strong positive feedback on the gas accretion rates, driven by the rapid contraction of the gaseous envelope and the rapid expansion of the outer boundary, which depends on the planet's total mass. The overall evolutionary time scale is generally determined by the length of the second phase. The actual rates at which the giant planets accreted small planetesimals is probably intermediate between the constant rates assumed in most previous studies and the highly variable rates that we have used. Within the context, of the adopted model of planetesimal accretion, the joint constraints of the time scale for dissipation of the solar nebula and the current high-Z masses of the giant planets lead to estimates of the initial surface density (sigma(sub init)) of planetesimals in the outer region of the solar nebula. The results show sigma(sub init) approx. = 10 g/sq cm near Jupiter's orbit and that sigma(sub init) proportional to alpha(sup -2), where alpha is the distance from the Sun. These values are a factor of 3 - 4 times as high as that of the "minimum mass" solar nebula at Jupiter's distance and a factor of 2 - 3 times as high it Saturn's distance. Our estimates for the formation time of Jupiter and Saturn are 1 - 10 million years while those for Uranus fall in the range of 2 - 16 million years. These estimates follow from the properties of our Solar System and do not necessarily apply to giant planets in other planetary systems.

Pollack, James B.↗

Polar catastrophe and the structure of KT a 1 - x N b x O 3 surfaces: Results from elastic and inelastic helium atom scattering

In this paper, the structure and dynamics of cleaved (001) surfaces of potassium tantalates doped with niobium, KTa 1-x Nb x O 3 (KTN), with x ranging from 0% to 30%, were measured by helium atom scattering (HAS). Through HAS time-of-flight (TOF) experiments, a dispersionless branch (Einstein phonon branch) with energy of 13-14meV was observed across the surface Brillouin zone in all samples. When this observation is combined with the results from earlier experimental and theoretical studies on these materials, a consistent picture of the stable surface structure emerges: After cleaving the single-crystal sample, the surface should be composed of equal areas of KO and TaO 2 /NbO 2 terraces. The data, however, suggest that K + and O 2- ions migrate from the bulk to the surface, forming a charged KO lattice that is neutralized primarily by additional K + ions bridging pairs of surface oxygens. This structural and dynamic modification at the (001) surface of KTN appears due to its formally charged KO(-1) and TaO 2 /NbO 2 (+1) layers and avoids a “polar catastrophe.” Finally, this behavior is contrasted with the (001) surface behavior of the fluoride perovskite KMnF 3 with its electrically neutral KF and MnF 2 layers.

36 MATERIALS SCIENCE↗

Diffusion-Reaction Modeling of Cu Migration in CdTe Solar Devices

In this work, we report on development of one-dimensional (1D) finite-difference and two-dimensional (2D) finite-element diffusion-reaction simulators to investigate mechanisms behind Cu-related metastabilities observed in CdTe solar cells [1]. The evolution of CdTe solar cells performance has been studied as a function of stress time in response to the evolution of associated acceptor and donor states. To achieve such capability, the simu-lators solve reaction-diffusion equations for the defect states in time-space domain self-consistently with the free carrier transport. Re-sults of 1-D and 2-D simulations have been compared to verify the accuracy of solutions.

Guo, Da↗

Electrochemical Doping of Halide Perovskites by Noble Metal Interstitial Cations

Abstract Metal halide perovskites are an attractive class of semiconductors, but it has proven difficult to control their electronic doping by conventional strategies due to screening and compensation by mobile ions or ionic defects. Noble‐metal interstitials represent an under‐studied class of extrinsic defects that plausibly influence many perovskite‐based devices. In this work, doping of metal halide perovskites is studied by electrochemically formed Au + interstitial ions, combining experimental data on devices with a computational analysis of Au + interstitial defects based on density functional theory (DFT). Analysis suggests that Au + cations can be easily formed and migrate through the perovskite bulk via the same sites as iodine interstitials (I i + ). However, whereas I i + compensates n‐type doping by electron capture, the noble‐metal interstitials act as quasi‐stable n‐dopants. Experimentally, voltage‐dependent, dynamic doping by current density–time ( J–t ), electrochemical impedance, and photoluminescence measurements are characterized. These results provide deeper insight into the potential beneficial and detrimental impacts of metal electrode reactions on long‐term performance of perovskite photovoltaic and light‐emitting diodes, as well as offer an alternative doping explanation for the valence switching mechanism of halide‐perovskite‐based neuromorphic and memristive devices.

14 SOLAR ENERGY↗

Exploring Responses of Contact Kelvin Probe Force Microscopy in Triple-Cation Double-Halide Perovskites

Hybrid organic–inorganic perovskite (HOIP) solar cells have undergone unprecedentedly rapid improvement in power conversion efficiencies during the last decade, but controversy remains regarding the role of local phenomena and heterogeneity in grain by grain. These challenges in turn necessitate understanding the fundamental mechanisms operating at individual grains and exploring how these mechanisms give rise to the collective behaviors of the films. Although numerous efforts have targeted local phenomena in these materials using classical scanning probe microscopy modalities, the measurements remain difficult to interpret due to intrinsic coupling between possible ferroelectric, ion migration, bulk and surface electrochemical phenomena, and the effects of light on these behaviors. Here, we explore the electromechanical responses in (Cs 0.05 FA 0.85 MA 0.15 )Pb(I 0.85 Br 0.15 ) 3 perovskite thin film in the dark and under illumination using band excitation-piezoresponse force microscopy (BE-PFM). To identify and separate ferroic, electrostatic, and electrochemical responses, we utilize contact-Kelvin probe force microscopy (cKPFM). The cKPFM responses show weak variability with morphological features in the dark, while such variability significantly increases under illumination. Deconvolution of the cKPFM responses via principal component analysis (PCA) shows heterogeneity in grain to grain possibly due to variation in migration and segregation of halide ions in mixed perovskites at specific grains. Further, we propose an electrostatic mechanism based on the physics of semiconductors, which can directly link the observed cKPFM behaviors with the ionic and electronic density of states (DOS) and their time dynamics. Here, these findings suggest that cKPFM is a powerful probe of local ionic behaviors on the nanoscale, both in HOIPs and other materials.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Ultrafine CoO nanoparticles as an efficient cocatalyst for enhanced photocatalytic hydrogen evolution

In order to further enhance the performance of photocatalysts, cocatalysts are used to accelerate the photocatalytic reactions. Herein, ultrafine cobalt oxide (CoO) nanoparticles are synthesized through a novel bottom-up strategy and explored as an efficient non-noble cocatalyst to dramatically promote the photocatalytic hydrogen evolution rate of CdS nanorods. CdS/CoO heterostructures, consisting of highly dispersed 3–5 nm CoO nanoparticles anchored on the CdS nanorods, can provide a high photocatalytic hydrogen evolution rate of 6.45 mmol g -1 h -1 (~36 times higher than that of bare CdS nanorods) in the visible-light region (>420 nm). Combined X-ray photoelectron spectroscopy and X-ray absorption near edge spectroscopy analyses suggest Co–S bond formation between CoO and CdS, which guarantees efficient migration and separation of photogenerated charge carriers. This work provides a new avenue for adopting CoO as an effective cocatalyst for enhanced photocatalytic hydrogen production in the visible-light region.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

In-situ Microscopy Characterization of Cu(In,Ga)Se2 Potential-Induced Degradation

We report on the role of sodium in potentialinduced degradation (PID) of Cu(In, Ga)Se 2 (CIGS) solar cells. In-situ microscopy characterizations on AFM platform were performed on two stressed CIGS device under room temperature (RT) and high temperature (HT) at 85 degrees C. During PID stressing we observed depletion region gets wider as Na migrates, p-n junction becomes leaky at RT for over a month; and similar junction evolution was observed for HT-stressed sample, eventually the junction collapsed after 18 hours. The diode behaviors were confirmed by dark I-V measurement. Time-of Flight secondary-ion mass spectrometry reveals that the Na accumulates on ZnO and CdS side, as well as the upper layer of CIGS layer. The results indicate that Na drifted by the voltage applied on the soda-lime glass, then diffuse through the whole device. And the sodium profiles have different points of evolution due to the temperature differences between the two stressed samples. The consistent results unambiguously show how Na from substrate glass causes PID in CIGS solar cells.

14 SOLAR ENERGY↗

Long range radio tracking of sea turtles and polar bear: Instrumentation and preliminary results

Instrumentation developed for studies of path behavior of the green sea turtle and migration movement of polar bear is described. Preliminary results bearing on navigation ability in these species are presented. Both species operate in difficult environments, and the problems faced in the design of electronic instrumentation for these studies are not completely specified at this time. However, the critical factors yet to be understood are primarily related to the behavior of instrumented animals. The data obtained with these experimental techniques are included, first to illustrate the technique and, second to provide initial preliminary results bearing on animal navigation.

Baldwin, H. A.↗

Electromigration failure in YBa2Cu3O(7-x) thin films

Electromigration failure in highly oriented YBa2Cu3O(7-x) thin films below the superconducting transition temperature is reported here for the first time. The film on SrTiO3 failed at 86 K, 230,000 A/sq cm, while that on LaAlO3 failed at 84 K, 930,000 A/sq cm. Scanning electron microscopy and energy dispersive X-ray analysis of the films after failure shows that Cu migrates preferentially away from the failure region toward the electrode.

Vitta, Satish↗

Development of Secondary Archive System at Goddard Space Flight Center Version 0 Distributed Active Archive Center

The Goddard Space Flight Center (GSFC) version 0 Distributed Active Archive Center (DAAC) has been developed to support existing and pre Earth Observing System (EOS) Earth science datasets, facilitate the scientific research, and test EOS data and information system (EOSDIS) concepts. To ensure that no data is ever lost, each product received at GSFC DAAC is archived on two different media, VHS and digital linear tape (DLT). The first copy is made on VHS tape and is under the control of UniTree. The second and third copies are made to DLT and VHS media under a custom built software package named 'Archer'. While Archer provides only a subset of the functions available with commercial software like UniTree, it supports migration between near-line and off-line media and offers much greater performance and flexibility to satisfy the specific needs of a data center. Archer is specifically designed to maximize total system throughput, rather than focusing on the turn-around time for individual files. The commercial off the shelf software (COTS) hierarchical storage management (HSM) products evaluated were mainly concerned with transparent, interactive, file access to the end-user, rather than a batch-orientated, optimizable (based on known data file characteristics) data archive and retrieval system. This is critical to the distribution requirements of the GSFC DAAC where orders for 5000 or more files at a time are received. Archer has the ability to queue many thousands of file requests and to sort these requests into internal processing schedules that optimize overall throughput. Specifically, mount and dismount, tape load and unload cycles, and tape motion are minimized. This feature did not seem to be available in many COTS pacages. Archer also uses a generic tar tape format that allows tapes to be read by many different systems rather than the proprietary format found in most COTS packages. This paper discusses some of the specific requirements at GSFC DAAC, the motivations for implementing the Archer system, and presents a discussion of the Archer design that resulted.

Sherman, Mark↗

Sputtering Erosion in the Ion Thruster

During the first phase of this research, the sputtering yields of molybdenum by low energy (100 eV and higher) xenon ions were measured by using the methods of secondary neutral mass spectrometry (SNMS) and Rutherford backscattering spectrometry (RBS). However, the measured sputtering yields were found to be far too low to explain the sputtering erosions observed in the long-duration tests of ion thrusters. The only difference between the sputtering yield measurement experiments and the ion thruster tests was that the later are conducted at high ion fluences. Hence, a study was initiated to investigate if any linkage exists between high ion fluence and an enhanced sputtering yield. The objective of this research is to gain an understanding of the causes of the discrepancies between the sputtering rates of molybdenum grids in an ion thruster and those measured from our experiments. We are developing a molecular dynamics simulation technique for studying low-energy xenon ion interactions with molybdenum. It is difficult to determine collision sequences analytically for primary ions below the 200 eV energy range where the ion energy is too low to be able to employ a random cascade model with confidence and it is too high to have to consider only single collision at or near the surface. At these low energies, the range of primary ions is about 1 to 2 nm from the surface and it takes less than 4 collisions on the average to get an ion to degrade to such an energy that it can no longer migrate. The fine details of atomic motion during the sputtering process are revealed through computer simulation schemes. By using an appropriate interatomic potential, the positions and velocities of the incident ion together with a sufficient number of target atoms are determined in small time steps. Hence, it allows one to study the evolution of damages in the target and its effect on the sputtering yield. We are at the preliminary stages of setting up the simulation program.

Ray, Pradosh K.↗

Integrating D3 Technology into an Existing DMF Configuration

The Numerical Aerodynamics Simulation (NAS) Facility's CRAY C916/1024 has 240+ GB of SuperHome storage with 2 TB of migrated storage. NAS is a beta test site for the Storage Technology Corporation (STK) Redwood (SD-3) device and Cray's DMF 2.3. This discussion will include a list of resolved problems and various metrics relative to transfer, search, rewind, unload, and mount timings. Also covered will be how DMF 2.3 with the advance tape MSP will integrate the Redwood tape drives along with the existing STK 4490 tape drives to potentially reduce the number of tapes used by 85%.

Powers, Alan K.↗

Aura/MLS Observes and SD-WACCM-X Simulates the Seasonality, Quasi-Biennial Oscillation and El Niño-Southern Oscillation of the Migrating Diurnal Tide Driving Upper Mesospheric CO Primarily Through Vertical Advection

This work uses 17 years of upper mesospheric carbon monoxide (CO) and temperature observations by the Microwave Limb Sounder (MLS) on-board the Aura satellite to present and explain the seasonal and interannual variability of the migrating diurnal tide (DW1) component of upper mesospheric CO. This work then compares these observations to simulations by the Specified Dynamics – Whole Atmosphere Community Climate Model with Ionosphere/Thermosphere eXtension (SD-WACCM-X). Results show that, for all seasons, MLS CO local-time perturbations peaks above 85 km and has a latitude structure resembling the (1,1) mode in temperature. On the other hand, SD-WACCM-X DW1 also peaks above 85 km and has a latitude structure resembling the (1,1) mode but it simulates 2 local maximum of the (1,1) mode between 85 km and 92 km. Despite the differences in altitude structure, a tendency analysis and the adiabatic displacement method revealed that, on seasonal and interannual timescales, observed and modelled CO’s (1,1) component can be reproduced solely using vertical advection. It was also found that both observed and modelled CO’s (1,1) component contains interannual oscillations with periodicities close to that of the Quasi-biennial Oscillation and the El Niño–Southern Oscillation. From these results, this work concludes that on seasonal and interannual timescales, the observed and modelled (1,1) mode affects the global structure of upper mesospheric CO primarily through vertical advection.

Cornelius Csar Jude H Salinas↗

Aura/MLS Observes, and SD-WACCM-X Simulates the Seasonality, Quasi-Biennial Oscillation and El Nino Southern Oscillation of the Migrating Diurnal Tide Driving Upper Mesospheric Co Primarily Through Vertical Advection

This work uses 17 years of upper mesospheric carbon monoxide (CO) and temperature observations by the Microwave Limb Sounder (MLS) on-board the Aura satellite to present and explain the seasonal and interannual variability of the migrating diurnal tide (DW1) component of upper mesospheric CO. This work then compares these observations to simulations by the Specified Dynamics – Whole Atmosphere Community Climate Model with Ionosphere/Thermosphere eXtension (SD-WACCM-X). Results show that, for all seasons, MLS CO local-time perturbations peaks above 85 km and has a latitude structure resembling the (1,1) mode in temperature. On the other hand, SD-WACCM-X DW1 also peaks above 85 km and has a latitude structure resembling the (1,1) mode but it simulates 2 local maximum of the (1,1) mode between 85 km and 92 km. Despite the differences in altitude structure, a tendency analysis and the adiabatic displacement method revealed that, on seasonal and interannual timescales, observed and modelled CO’s (1,1) component can be reproduced solely using vertical advection. It was also found that both observed and modelled CO’s (1,1) component contains interannual oscillations with periodicities close to that of the Quasi-biennial Oscillation and the El Nino Southern Oscillation. From these results, this work concludes that on seasonal and interannual timescales, the observed and modelled (1,1) mode affects the global structure of upper mesospheric CO primarily through vertical advection.

Cornelius Csar Jude H. Salinas↗

Aerosol Meteorology of the Maritime Continent for the 2012 7SEAS Southwest Monsoon Intensive Study - Part 1: Regional-scale Phenomena

The largest 7 Southeast Asian Studies (7SEAS) operation period within the Maritime Continent (MC) occurred in the August-September 2012 biomass burning season. Included was an enhanced deployment of Aerosol Robotic Network (AERONET) sun photometers, multiple lidars, and field measurements to observe transported smoke and pollution as it left the MC and entered the southwest monsoon trough. Here we describe the nature of the overall 2012 southwest monsoon (SWM) and biomass burning season to give context to the 2012 deployment. The MC in 2012 was in a slightly warm El Nino Southern Oscillation (ENSO) phase and with spatially typical burning activity. However, overall fire counts for 2012 were 10 lower than the Reid et al. (2012) baseline, with regions of significant departures from this norm, ranging from southern Sumatra (+30) to southern Kalimantan (42). Fire activity and monsoonal flows for the dominant burning regions were modulated by a series of intraseasonal oscillation events (e.g., Madden-Julian Oscillation, or MJO, and boreal summer intraseasonal oscillation, or BSISO). As is typical, fire activity systematically progressed eastward over time, starting with central Sumatran fire activity in June related to a moderately strong MJO event which brought drier air from the Indian Ocean aloft and enhanced monsoonal flow. Further burning in Sumatra and Kalimantan Borneo occurred in a series of significant events from early August to a peak in the first week of October, ending when the monsoon started to migrate back to its wintertime northeastern flow conditions in mid-October. Significant monsoonal enhancements and flow reversals collinear with tropical cyclone (TC) activity and easterly waves were also observed. Islands of the eastern MC, including Sulawesi, Java, and Timor, showed less sensitivity to monsoonal variation, with slowly increasing fire activity that also peaked in early October but lingered into November. Interestingly, even though fire counts were middling, resultant AERONET 500nm aerosol optical thickness (AOT) from fire activity was high, with maximums of 3.6 and 5.6 in the Sumatra and Kalimantan source regions at the end of the burning season and an average of approximately 1. AOTs could also be high at receptor sites, with a mean and maximum of 0.57 and 1.24 in Singapore and 0.61 and 0.8 in Kuching Sarawak. Ultimately, outside of the extreme 2015 El Nino event, average AERONET AOT values were higher than any other time since sites were established. Thus, while satellite fire data, models, and AERONET all qualitatively agree on the nature of smoke production and transport, the MC's complex environment resulted in clear differences in quantitative interpretation of these datasets.

Reid, Jeffrey S.↗

Numerical Modelling of Radionuclide Migration in the Context of a Near-Surface LILW Disposal Facility - 18618

The reference solution for the management of low and intermediate level short-lived waste (LILW) in France consists in their emplacement in concrete vaults built at the near-surface. The corresponding disposal facility under operation by the French waste management organization (Andra), is located in North-eastern France and planned to be closed in 2060. The safety case developed by Andra has to show the evidence that, amongst other aspects, the radionuclide transfer through the confinement barriers will occur in such a way that the human and environmental exposure will be as low as reasonably achievable (ALARA) and in accordance with the dose constraints. For this purpose, modelling is used to integrate uncertainties about the characteristics of concrete components, waste and water table and their evolution in time and space. At last, modelling is finally used to investigate the radiological impact of specific scenarios in which the failure of safety barriers occurs. In the frame of its technical review of the safety assessment, the French Institute for Radiological Protection and Nuclear Safety (IRSN) also performs such kind of numerical modelling of radionuclide fate from the waste to the hydrogeological outlets, in order to check whether the assessment performed by Andra takes into account sufficiently conservative assumptions. The present work aims to evaluate the role of components of the vaults on radionuclide transport during the post-closure period over a few thousand years. For this purpose, IRSN carries out numerical calculations with MELODIE software, which simulates water flow and transport of species, in order to simulate radionuclide migration from waste packages emplaced in a concrete vault to the surrounding groundwater. The developed transport model focuses on 3-H radionuclide and integrates Andra's main assumptions (release model from the waste packages, chemical and hydraulic properties of the vault components, shrinkage and cracks in concrete components). An adaptive mesh method, based on an a posteriori error estimator, was used to model the cracks and the consideration of a strong heterogeneity in the hydraulic and transport parameters values in the different components of the model. This method shows an improvement of results of about 40 times, whereas the mesh size was increased by only 2%. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Impacts of Dissolved Ni 2+ on the Solid Electrolyte Interphase on a Graphite Anode

Transition metal (e.g. Ni) ions dissolved from layered-structured Ni-rich cathodes can migrate to the anode side and accelerate the failure of lithium-ion batteries. The investigations of the impact and distribution of Ni species on the solid electrolyte interphase (SEI) on the anode are crucial to understand the failure mechanism. Herein, we used time-of-flight secondary ion mass spectroscopy (TOF-SIMS) coupled with multivariate curve resolution (MCR) analysis to intuitively characterize the distribution of Ni species in the SEI. We find that the SEI on the graphite electrode using an EC-based electrolyte exhibits a multi-stratum structure. During accelerated aging of the LiNi 0.88 Co 0.08 Mn 0.04 O 2 /graphite full cell, the dissolution of Ni aggravates significantly upon cycling. A strong correlation between the dissolved-Ni and organic species in the SEI on graphite is illustrated. Here, the ion-exchange reaction between Ni 2+ and Li + ions in the SEI is demonstrated to be the main reason for the increase of SEI resistivity.

25 ENERGY STORAGE↗