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At least 541 records · Page 30

Computational studies of metal-metal and metal-ligand interactions

Accurate calculations on the bond length, dipole moment, and harmonic frequency of CO are presented, using large basis sets and high levels of electron correlation. The geometric structure, force constants and binding energies of Cr(C0)6 and Cr(CO)5 are computed using large basis sets and high levels of electron correlation. The molecule 04(+) is studied, using large basis sets and high levels of electron correlation, including the CASSCF, CASSI and CASPT2 methods. Binding energies, geometries and frequencies are computed. Symmetry breaking is a particular problem for the antisymmetric stretch, which is addressed using the CASSI method. The symmetry breaking problem in 04(+) has also been studied using the Brueckner coupled cluster method. This gives results in good agreement with CASSI. A multi-region numerical integration scheme is investigated for use in Density Functional Calculations. This scheme is found to give comparable results to a widely used scheme based on the Euler-Maclaurin technique.

Barnes, Leslie A.↗

Computational studies of metal-metal and metal-ligand interactions

Accurate calculations on the bond length, dipole moment, and harmonic frequency of CO are presented, using large basis sets and high levels of electron correlation. The geometric structure, force constants and binding energies of Cr(CO)6 and Cr(CO)5 are computed using large basis sets and high levels of electron correlation. The molecule O4(+) is studied, using large basis sets and high levels of electron correlation, including the CASSCF, CASSI,and CASPT2 methods. Binding energies, geometries and frequencies are computed. Symmetry breaking is a particular problem for the antisymmetric stretch, which is addressed using the CASSI method. The symmetry breaking problem in O4(+) has also been studied using the Brueckner coupled-cluster method. This gives results in good agreement with CASSI. A multi-region numerical integration scheme is investigated for use in Density Functional Calculations. This scheme is found to give comparable results to a widely used scheme based on the Euler-Maclaurin technique.

Barnes, Leslie A.↗

Landsat 9 Micrometeoroid and Orbital Debris (MMOD) Mission Success Approach

Landsat 9* (L9) is the successor mission to Landsat 8 (L8) previously known as Landsat Data Continuity Mission (LDCM). Both missions are large unmanned remote sensing satellites operating in sunsynchronous polar orbits. As opposed to L8/LDCM, systems engineers for L9 incorporated Micrometeoroid/Orbital Debris (MMOD) protection for small object collisions as part of the L9’s mission success criteria. In other words, the NASA Process for Limiting Orbital Debris (NASA-STD-8719.14A) only calls for analyses of the protection of disposal-critical hardware, but L9 opted to also assess and provide small particle penetration protections for all observatory components including instruments that are not part of the spacecraft components needed for controlled reentry. Systems engineers at Goddard developed a design process to protect against MMOD during the life of Low Earth Orbit (LEO) observatories, and in particular the Landsat 9 Mission. Simply stated, this design process enhanced the effectiveness of existing Multi-Layer Insulation (MLI) to provide the needed protection. The end goal of the design process was to establish a necessary blanket areal density for a given electronics box or instrument wall thickness and a separation between the outer MLI blanket and the structure underneath. The trade space was presented as a set of design curves for different combinations of blanket density, box wall thickness, and separation distance between MLI and structure. An advantage of this process was that it is largely independent of MMOD flux data on a surface-by surface basis. Ultimately, cost savings should result from incorporating small object penetration protection early in the design cycle, rather than adding spot shielding blankets later as needed to meet an overall penetration risk standard (the more traditional approach). The approach and implementation to the L9 Observatory design will be addressed in this paper. *L9 is a joint mission being formulated, implemented, and operated by the National Aeronautics and Space Administration (NASA) and the Department of the Interior’s (DOI) United States Geological Survey (USGS).

Approach↗

Determining torques over the ocean and their role in the planetary momentum budget

The transfer of angular momentum between the atmosphere and oceans was examined using a surface wind data set. The data set combines special sensor microwave imager wind speed estimates and operational wind analyses from the European Centre for Medium Range Weather Forecasts for estimation of zonal torques over the global ocean from July 1987 to June 1989. An attempt was made to determine the global space-time structure of ocean torques. The wind data sets are described, the general statistics of local and global torques are presented, and their characteristics were evaluated. Consideration is given to the impact of satellite data on the calculation of local and global torques. The contribution of ocean torques to fluctuations in atmospheric angular momentum was analyzed as a function of time scale and geographical location.

Ponte, Rui M.↗

NASA GES DISC On-line Visualization and Analysis System for Gridded Remote Sensing Data

The ability to use data stored in the current NASA Earth Observing System (EOS) archives for studying regional or global phenomena is highly dependent on having a detailed understanding of the data's internal structure and physical implementation. Gaining this understanding and applying it to data reduction is a time-consuming task that must be undertaken before the core investigation can begin. This is an especially difficult challenge when science objectives require users to deal with large multi-sensor data sets that are usually of different formats, structures, and resolutions. The NASA Goddard Earth Sciences Data and Information Services Center (GES DISC) has taken a major step towards meeting this challenge by developing an infrastructure with a Web interface that allows users to perform interactive analysis online without downloading any data, the GES-DISC Interactive Online Visualization and Analysis Infrastructure or "Giovanni." Giovanni provides interactive, online, analysis tools for data users to facilitate their research. There have been several instances of this interface created to serve TRMM users, Aerosol scientists, Ocean Color and Agriculture applications users. The first generation of these tools support gridded data only. The user selects geophysical parameters, area of interest, time period; and the system generates an output on screen in a matter of seconds. The currently available output options are: Area plot averaged or accumulated over any available data period for any rectangular area; Time plot time series averaged over any rectangular area; Hovmoller plots image view of any longitude-time and latitude-time cross sections; ASCII output for all plot types; Image animation for area plot. Another analysis suite deals with parameter intercomparison: scatter plots, temporal correlation maps, GIs-compatible outputs, etc. This allow user to focus on data content (i.e. science parameters) and eliminate the need for expensive learning, development and processing tasks that are redundantly incurred by an archive's user community. The current implementation utilizes the GrADS-DODS Server (GDS), and provides subsetting and analysis services across the Internet for any GrADS-readable dataset. The subsetting capability allows users to retrieve a specified temporal and/or spatial subdomain from a large dataset, eliminating the need to download everything simply to access a small relevant portion of a dataset. The analysis capability allows users to retrieve the results of an operation applied to one or more datasets on the server. We use this approach to read pre-processed binary files and/or to read and extract the needed parts directly from HDF or HDF-EOS files. These subsets then serve as inputs into GrADS analysis scripts. It can be used in a wide variety of Earth science applications: climate and weather events study and monitoring; modeling. It can be easily configured for new applications.

Leptoukh, Gregory G.↗

Orbit structure of Hamiltonian systems arising from Lie transformation group actions

This paper associates the Riccati group and its group action on linear-quadratic optimal control problems to the action of a Lie transformation group on a set of Hamiltonian matrices. In this Lie theoretic setting results are presented concerning the associated orbit structure and the structure of the group itself. These results are of importance in understanding the solution structure of matrix Riccati differential equations, and thus also of importance in linear-quadratic optimal control.

Garzia, M. R.↗

Electrical Breakdown of Anodized Structures in a Low Earth Orbital Environmental

A comprehensive set of investigations involving arcing on a negatively biased anodized aluminum plate immersed in a low density argon plasma at low pressures (P(sub O), 7.5 x 10(exp -5) Torr) have been performed. These arcing experiments were designed to simulate electrical breakdown of anodized coatings in a Low Earth Orbital (LEO) environment. When electrical breakdown of an anodized layer occurs, an arc strikes, and there is a sudden flux of electrons accelerated into the ambient plasma. This event is directly followed by ejection of a quasi-neutral plasma cloud consisting of ejected material blown out of the anodized layer. Statistical analysis of plasma cloud expansion velocities have yielded a mean propagation velocity, v = (19.4 +/- 3.5) km/s. As the plasma cloud expands into the ambient plasma, energy in the form of electrical noise is generated. The radiated electromagnetic noise is detected by means of an insulated antenna immersed in the ambient plasma. The purpose of the investigations is (1) to observe and record the electromagnetic radiation spectrum resulting from the arcing process. (2) Make estimates of the travel time of the quasi-neutral plasma cloud based on fluctuations to several Langmuir probes mounted in the ambient plasma. (3) To study induced arcing between two anodized aluminum structures in close proximity.

Galofaro, J. T.↗

Dynamics of directional reflectance factor distributions for vegetation canopies

Directional reflectance factors that span the entire exitance hemisphere are collected on the ground for a variety of homogeneous vegetation canopies and bare soils. NOAA 6/7 AVHRR bands 1 (0.58-0.68 micron) and 2 (0.73-1.1 microns) are used. When possible, geometric measurements of leaf orientation distributions are taken simultaneously with each spectral measurement. Other supporting structural and optical measurements are made. These data sets are taken at various times of the day for each cover type. These unique sets, together with pertinent data in the literature, are used to investigate the dynamics of the directional reflectance factor distribution as a function of the geometric structure of the scene, solar zenith angle, and optical properties of the scene components (leaves and soil). For complete homogeneous vegetation canopies, the principal trend observed at all sun angles and spectral bands is a minimum reflectance near nadir and increasing reflectance with increasing off-nadir view angle for all azimuth directions.

Kimes, D. S.↗

The computational structural mechanics testbed architecture. Volume 5: The Input-Output Manager DMGASP

This is the fifth of a set of five volumes which describe the software architecture for the Computational Structural Mechanics Testbed. Derived from NICE, an integrated software system developed at Lockheed Palo Alto Research Laboratory, the architecture is composed of the command language (CLAMP), the command language interpreter (CLIP), and the data manager (GAL). Volumes 1, 2, and 3 (NASA CR's 178384, 178385, and 178386, respectively) describe CLAMP and CLIP and the CLIP-processor interface. Volumes 4 and 5 (NASA CR's 178387 and 178388, respectively) describe GAL and its low-level I/O. CLAMP, an acronym for Command Language for Applied Mechanics Processors, is designed to control the flow of execution of processors written for NICE. Volume 5 describes the low-level data management component of the NICE software. It is intended only for advanced programmers involved in maintenance of the software.

Felippa, Carlos A.↗

Crew/computer communications study. Volume 1: Final report

Techniques, methods, and system requirements are reported for an onboard computerized communications system that provides on-line computing capability during manned space exploration. Communications between man and computer take place by sequential execution of each discrete step of a procedure, by interactive progression through a tree-type structure to initiate tasks or by interactive optimization of a task requiring man to furnish a set of parameters. Effective communication between astronaut and computer utilizes structured vocabulary techniques and a word recognition system.

Johannes, J. D.↗

Structural Optimization

Programming Structural Synthesis System (PROSSS) provides structural synthesis capability by combining SPAR and CONMIN computer programs with set of interface procedures. SPAR is large general-purpose finite-element structural-analysis program, and CONMIN is large general-purpose optimization program. User supplies two small problem-dependent programs to define design variables, constraints, and objective function.

Rogers, J. L., Jr↗

Structure identification in fuzzy inference using reinforcement learning

In our previous work on the GARIC architecture, we have shown that the system can start with surface structure of the knowledge base (i.e., the linguistic expression of the rules) and learn the deep structure (i.e., the fuzzy membership functions of the labels used in the rules) by using reinforcement learning. Assuming the surface structure, GARIC refines the fuzzy membership functions used in the consequents of the rules using a gradient descent procedure. This hybrid fuzzy logic and reinforcement learning approach can learn to balance a cart-pole system and to backup a truck to its docking location after a few trials. In this paper, we discuss how to do structure identification using reinforcement learning in fuzzy inference systems. This involves identifying both surface as well as deep structure of the knowledge base. The term set of fuzzy linguistic labels used in describing the values of each control variable must be derived. In this process, splitting a label refers to creating new labels which are more granular than the original label and merging two labels creates a more general label. Splitting and merging of labels directly transform the structure of the action selection network used in GARIC by increasing or decreasing the number of hidden layer nodes.

Berenji, Hamid R.↗

Atmospheric measurements using the LAMP lidar during the LADIMAS campaign

The results of the LAtitudinal DIstribution of Middle Atmosphere Structure (LADIMAS) experiment have provided a unique data set to improve our understanding of the middle atmosphere. The project included shipboard and rocket range coordinated measurements between 70 deg N to 65 deg S to study the structure, dynamics, and chemistry of the atmosphere. Results on important dynamical processes, such as gravity waves, tidal components, as well as the formation of the layers of meteoric ion and neutral species, were obtained with lidar, digisonde, microwave radiometer, and spectrometers. The cooperative study of the atmosphere was undertaken by researchers from several laboratories, including Penn State University (PSU), University Bonn, University Wuppertal, Lowell University, and others. Several of the parameters studied have never been measured before over such a wide range of latitudes. Instruments were assembled aboard the German research vessel RV POLARSTERN while this vessel was sailing from the Arctic to the Antarctic seas between 8 Oct. 1991 - 2 Jan. 1992. This paper presents an introduction to the data gathered by the PSU investigation with the Lidar Atmospheric Measurements Program (LAMP) lidar.

Philbrick, C. R.↗

Analysis and representation of complex structures in separated flows

We discuss our recent work on extraction and visualization of topological information in separated fluid flow data sets. As with scene analysis, an abstract representation of a large data set can greatly facilitate the understanding of complex, high-level structures. When studying flow topology, such a representation can be produced by locating and characterizing critical points in the velocity field and generating the associated stream surfaces. In 3D flows, the surface topology serves as the starting point. The 2D tangential velocity field near the surface of the body is examined for critical points. The tangential velocity field is integrated out along the principal directions of certain classes of critical points to produce curves depicting the topology of the flow near the body. The points and curves are linked to form a skeleton representing the 2D vector field topology. This skeleton provides a basis for analyzing the 3D structures associated with the flow separation. The points along the separation curves in the skeleton are used to start tangent curve integrations. Integration origins are successively refined to produce stream surfaces. The map of the global topology is completed by generating those stream surfaces associated with 3D critical points.

Helman, James↗

An introduction to using the FORTRAN programs provided with Computational Nuclear Physics 1 Nuclear Structure

The authors of this paper have provided a set of ready-to-run FORTRAN programs that should be useful in the field of theoretical nuclear physics. The purpose of this document is to provide a simple synopsis of the programs and their use. A separate section is devoted to each program set and includes: abstract; files; compiling, linking, and running; obtaining results; and a tutorial.

Boytos, Matthew A.↗

Aero-Thermo-Structural Design Optimization of Internally Cooled Turbine Blades

A set of robust and computationally affordable inverse shape design and automatic constrained optimization tools have been developed for the improved performance of internally cooled gas turbine blades. The design methods are applicable to the aerodynamics, heat transfer, and thermoelasticity aspects of the turbine blade. Maximum use of the existing proven disciplinary analysis codes is possible with this design approach. Preliminary computational results demonstrate possibilities to design blades with minimized total pressure loss and maximized aerodynamic loading. At the same time, these blades are capable of sustaining significantly higher inlet hot gas temperatures while requiring remarkably lower coolant mass flow rates. These results suggest that it is possible to design internally cooled turbine blades that will cost less to manufacture, will have longer life span, and will perform as good, if not better than, film cooled turbine blades.

Dulikravich, G. S.↗

Geophysical characteristics and crustal structure of greenstone terranes: Canadian Shield

Geophysical studies in the Canadian Shield have provided some insights into the tectonic setting of greenstone belts. Greenstone belts are not rooted in deep crustal structures. Geophysical techniques consistently indicate that greenstones are restricted to the uppermost 10 km or so of crust and are underlain by geophysically normal crust. Gravity models suggest that granitic elements are similarly restricted, although magnetic modelling suggests possible downward extension to the intermediate discontinuity around approx. 18 km. Seismic evidence demonstrates that steeply-dipping structure, which can be associated with the belts in the upper crust, is not present in the lower crust. Horizontal intermediate discontinuities mapped under adjacent greenstone and granitic components are not noticeably disrupted in the boundary zone. Geophysical evidence points to the presence of discontinuities between greenhouse-granite and adjacent metasedimentary erranes. Measured stratigraphic thicknesses of greenstone belts are often twice or more the vertical thicknesses determined from gravity modelling. Explantations advanced for the discrepancy include stratigraphy repeated by thrust faulting and/or listric normal faulting, mechanisms which are consistent with certain aspects of conceptual models of greenstone development. Where repetition is not a factor the gravity evidence points to removal of the root zones of greenstone belts. For one region, this has been attributed to magmatic stopping during resurgent caldera activity.

Thomas, M. D.↗

The FIRE Project

The International Satellite Cloud Climatology Project's (ISCCP) First ISCCP Regional Experiment (FIRE) project is a program to validate the cloud parameters derived by the ISCCP. The 4- to 5-year program will concentrate on clouds in the continental United States, particularly cirrus and marine stratocumulus clouds. As part of the validation process, FIRE will acquire satellite, aircraft, balloon, and surface data. These data (except for the satellite data) will be amalgamated into one common data set. Plans are to generate a standardized format structure for use in the PCDS. Data collection will begin in April 1986, but will not be available to the general scientific community until 1987 or 1988. Additional pertinent data sets already reside in the PCDS. Other qualifications of the PCDS for use in this validation program were enumerated.

Mcdougal, D.↗