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At least 145 records · Page 8

The error associated with use of various forms of the divergence equation to diagnose geopotential and temperature

This study utilizes a model-generated data set to evaluate the errors associated with the diagnosis of geopotential height using three approximate forms of the divergence equation (DE). The DE was solved on the original sigma-coordinate surfaces of the model to exclude any error produced in the process of interpolating the data from observation points to the coordinate surface of the DE. An inviscid, nonlinear, divergent DE produced rms geopotential height errors as large as 3 m and rms temperature errors of over 26 C in the lower planetary boundary layer (PBL), with minimal errors above 800 mb. Elimination of the isobaric divergence in the velocity field caused additional height errors of 5-6 m and temperature errors of 0.4-1.2 C in the free troposphere. Use of a further-degraded DE without nonlinear terms caused height errors of 10-15 m in the upper troposphere with modestly increased temperature errors. Error fields at all levels had synoptic-scale features, with some mesoalpha structure. No spatial noise was apparent. Use of a temporal spectral filter to eliminate high-frequency modes from the model-generated data did not significantly influence the error associated with use of various forms of the DE.

Modica, George M.↗

Stochastic machine learning via sigma profiles to build a digital chemical space

This work establishes a different paradigm on digital molecular spaces and their efficient navigation by exploiting sigma profiles. To do so, the remarkable capability of Gaussian processes (GPs), a type of stochastic machine learning model, to correlate and predict physicochemical properties from sigma profiles is demonstrated, outperforming state-of-the-art neural networks previously published. The amount of chemical information encoded in sigma profiles eases the learning burden of machine learning models, permitting the training of GPs on small datasets which, due to their negligible computational cost and ease of implementation, are ideal models to be combined with optimization tools such as gradient search or Bayesian optimization (BO). Gradient search is used to efficiently navigate the sigma profile digital space, quickly converging to local extrema of target physicochemical properties. While this requires the availability of pretrained GP models on existing datasets, such limitations are eliminated with the implementation of BO, which can find global extrema with a limited number of iterations. A remarkable example of this is that of BO toward boiling temperature optimization. Holding no knowledge of chemistry except for the sigma profile and boiling temperature of carbon monoxide (the worst possible initial guess), BO finds the global maximum of the available boiling temperature dataset (over 1,000 molecules encompassing more than 40 families of organic and inorganic compounds) in just 15 iterations (i.e., 15 property measurements), cementing sigma profiles as a powerful digital chemical space for molecular optimization and discovery, particularly when little to no experimental data is initially available.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Winter and summer simulations with the GLAS climate model

The GLAS climate model is a general circulation model based on the primitive equations in sigma coordinates on a global domain in the presence of orography. The model incorporates parameterizations of the effects of radiation, convection, large scale latent heat release, turbulent and boundary layer fluxes, and ground hydrology. Winter and summer simulations were carried out with this model, and the resulting data are compared to observations.

Shukla, J.↗

Modifications to the steady-state 41-node thermoregulatory model including validation of the respiratory and diffusional water loss equations

After the simplified version of the 41-Node Stolwijk Metabolic Man Model was implemented on the Sigma 3 and UNIVAC 1110 computers in batch mode, it became desirable to make certain revisions. First, the availability of time-sharing terminals makes it possible to provide the capability and flexibility of conversational interaction between user and model. Secondly, recent physiological studies show the need to revise certain parameter values contained in the model. Thirdly, it was desired to make quantitative and accurate predictions of evaporative water loss for humans in an orbiting space station. The result of the first phase of this effort are reported.

Source record↗

Space Storable Rocket Technology (SSRT) basic program

The Space Storable Rocket Technology Program (SSRT) was conducted to establish a technology for a new class of high performance and long life bipropellant engines using space storable propellants. The results are described. Task 1 evaluated several characteristics for a number of fuels to determine the best space storable fuel for use with LO2. The results indicated that LO2-N2H4 is the best propellant combination and provides the maximum mission/system capability maximum payload into GEO of satellites. Task 2 developed two models, performance and thermal. The performance model indicated the performance goal of specific impulse greater than or = 340 seconds (sigma = 204) could be achieved. The thermal model was developed and anchored to hot fire test data. Task 3 consisted of design, fabrication, and testing of a 200 lbf thrust test engine operating at a chamber pressure of 200 psia using LO2-N2H4. A total of 76 hot fire tests were conducted demonstrating performance greater than 340 (sigma = 204) which is a 25 second specific impulse improvement over the existing highest performance flight apogee type engines.

Chazen, M. L.↗

Influence of Ply Waviness on Fatigue Life of Tapered Composite Flexbeam Laminates

Nonlinear tapered flexbeam laminates, with significant ply waviness, were cut from a full-size composite rotor hub flexbeam. The specimens were tested under combined axial tension and cyclic bending loads. All of the specimens had wavy plies through the center and near the surfaces (termed marcelled areas), although for some of the specimens the surface marcels were very obvious, and for others they were much smaller. The specimens failed by first developing cracks through the marcels at the surfaces, and then delaminations grew from those cracks, in both directions. Delamination failure occurred in these specimens at significantly shorter fatigue lives than similar specimens without waviness, tested in ref. 2. A 2D finite element model was developed which closely approximated the flexbeam geometry, boundary conditions, and loading. In addition, the FE model duplicated the waviness observed in one of the test specimens. The model was analyzed using a geometrically nonlinear FE code. Modifications were made to the original model to reduce the amplitude of the marcels near the surfaces. The analysis was repeated for each modification. Comparisons of the interlaminar normal stresses, sigma(sub n), in the various models showed that under combined axial-tension and cyclic-bending loading, for marcels of the same aspect ratio, sigma(sub n) stresses increased as the distance along the taper, from thick to thin end, increased. For marcels of the same aspect ratio and at the same X-location along the taper, sigma(sub n) stresses decreased as the distance from the surface into the flexbeam interior increased. A technique was presented for determining the smallest acceptable marcel aspect ratio at various locations in the flexbeam.

Murri, Gretchen B.↗

A new approach for determining fully empirical altimeter wind speed model functions

A statistical technique is developed for determining fully empirical model functions relating altimeter backscatter (sigma(sub 0)) measurements to near-surface neutral stability wind speed. By assuming that sigma(sub 0) varies monotonically and uniquely with wind speed, the method requires knowledge only of the separate, rather than joint distribution functions of sigma(sub 0) and wind speed. Analytic simplifications result from using a Weibull distribution to approximate the global ocean wind speed distribution; several different wind data sets are used to demonstrate the validity of the Weibull approximation. The technique has been applied to 1 year of Geosat data. Validation of the new and historical model functions using an independent buoy data set demonstrates that the present model function not only has small overall bias and root mean square (RMS) errors, but yields smaller systematic error trends with wind speed and pseudowave age than previously published models. The present analysis suggests that generally accuracte altimeter model functions can be derived without the use of colocated measurements, nor is additional significant wave height information measured by the altimeter necessary.

Freilich, M. H.↗

A hydrodynamic approach to cosmology: The mixed dark matter cosmological scenario

We compute the evolution of spatially flat, mixed cold and hot dark matter models containing both baryonic matter and two kinds of dark matter. Hydrodynamics is treated with a highly developed Eulerian hydrodynamic code (see Cen 1992). A standard particle-mesh (PM) code is also used in parallel to calculate the motion of the dark matter components. We adopt the following parameters: h equivalent to (sub 0)/100 km/s Mpc(exp -1) = 0.5, OMEGA(sub C) = 0.3, and OMEGA(sub B) = 0.06, with amplitude of the perturbation spectrum fixed by the Cosmic Background Explorer Satellite (COBE) Dark Matter Radiation (DMR) measurements (Smoot et al. 1992) being sigma (sub 8) = 0.67. Four different boxes are simulated with box sizes of L = (64, 16, 4, 1) h(exp -1) Mpc, respectively, the two small boxes providing good resolution but little valid information due to absence of large-scale power. We use 128(exp 3) approximate 10(exp 6.3) baryonic cells, 128(exp .3) cold dark matter particles, and 2 x 128(exp 3) hot dark matter particles. In addition to the dark matter we follow separately six baryonic species (H, H(+), He, He(+), He(++), e(-)) with allowance for both (nonequilibrium) collisional and radiative ionization in every cell. The background radiation field is also followed in detail with allowance made for both continuum and line processes, to allow nonequilibrium heating and cooling processes to be followed in detail. The mean final Zeldovich-Sunyaev y parameter is estimated to be y Bar = (5.4 + or - 2.7) x 10(exp -7) below currently attainable observations, with a rms fluctuation of approximately delta bar y = (0.6 + or - 3.0) x 10(exp -7) on arcminute scales. The rate of galaxy formation peaks at an even later epoch (z approximate 0.3) than in the standard (OMEGA = 1, sigma sub 8 = 0.67) cold dark matter (CDM) model (z approximate 0.5) and, at a redshift of z = 4, is nearly a factor of 100 lower than for the CDM model with the same value of sigma sub 8. With regard to mass function, the smallest objects are stabilized against collapse by thermal energy: the mass-weighted mass spectrum has a broad peak in the vicinity of M(sub B) = 10(exp 9.5) solar mass with a reasonable fit to the Schechter luminosity function if the ratio of baryon mass to blue light is approximately 4. In addition, one very large PM simulation was made in a box with size (320 h(exp - 1) Mpc) containing 3 x 200(exp 3) = 10(exp 7.4) particles. Utilizing this simulation we find that the model yields a cluster mass function which is about a factor of 4 higher than observed, but a cluster-cluster correlation length marginally lower than observed, but that both are closer to observations than in the (COBE) normalized CDM model. The one-dimensional pairwise velocity dispersion is 605 + or - 8 km/s at 1/h separation, lower than that of the DCM model normalized to COBE, but still significant higher than observations (Davis & Peebles 1983). A plausible velocity bias b(sub v) = 0.8 + or - 0.1 on this scale will reduce but not remove the discrepancy. The velocity auto-correlat ion function has a coherence length of 40/h Mpc, which is somewhat lower than the observed counterpart. In all these respects the model would be improved by decreasing the cold fraction of the dark OMEGA(sub CDM)/ (OMEGA(sub CDM) + OMEGA(sub HDB). But formation of galaxies and clusters of galaxies is much later in this model than in COBE-normalized CDM, perhaps too late. To improve on these constraints a larger ratio of OMEGA(sub CDM)/ (OMEGA(sub CDM) + OMEGA(sub HDM)) is required than the value of 0.67 adopted here. It does not seem possible to find a value for this ratio which would satisfy all tests. Overall, the model is similar both on large and intermediate scales to the standard CDM model normalized to the same value of sigma(sub B), but the problem with regard to late formation of galaxies is more severe in this model than in that CDM model. Adding hot dark matter, significantly improves the ability of the COBE-normalized CDM scenario to fit existing observations, but the model is in fact not as good as the CDM model with the same sigma(sub 8) and is still probably unsatisfactory with regard to several critical tests.

Cen, Renyue↗

A laboratory study of friction-velocity estimates from scatterometry - Low and high regimes

Measurements from scatterometers pointing at wind-waves in three large wave tanks are examined to study fetch effects and the correlation with wind friction velocity. Time-series measurements were made at 13, 35, and 95 m with a Ka-band scatterometer aimed upwind at 30 deg incidence angle and vertical polarization. Average normalized radar cross-section (sigma-0) values from all fetches follow a common trend for sigma-0 as a function of wind friction velocity, so the fetch dependence is negligible. An empirical power-law model yields a high correlation between sigma-0 and wind friction velocity, but, because systematic anomalies arise, we reexamine a turbulence approach that delineates low and high regimes with a transition at a wind friction velocity of approximately 25 cm/s. Using this criteria, the data are well represented by a two-section power-law relationship between sigma-0 and wind friction velocity.

Bliven, L. F.↗

BATSE Observations of Gamma-Ray Burst Spectra: Low-Energy Behavior of Time-Averaged Spectra - Part 3

We analyze time-averaged spectra from 86 bright gamma-ray bursts from the first 5 years of the Burst And Transient Source Experiment (BATSE) on board the Compton Gamma Ray Observatory to determine whether the lowest energy data are consistent with a standard spectra form fit to the data at all energies. The BATSE Spectroscopy Detectors have the capability to observe photons as low as 5 keV. Using the gamma-ray burst locations obtained with the BATSE Large Area Detectors, the Spectroscopy Detectors' low-energy response can be modeled accurately. This, together with a postlaunch calibration of the lowest energy Spectroscopy Detector discriminator channel, which can lie in the range 5-20 keV, allows spectral deconvolution over a broad energy range, approx. 5 keV to 2 MeV. The additional coverage allows us to search for evidence of excess emission, or for a deficit, below 20 keV. While no burst has a significant (greater than or equal to 3 sigma) deficit relative to a standard spectra model, we find that 12 bursts have excess low-energy emission, ranging between 1.2 and 5.8 times the model flux, that exceeds 5 sigma in significance. This is evidence for an additional low-energy spectral component in at least some bursts, or for deviations from the power-law spectral form typically used to model gamma-ray bursts at energies below 100 keV.

Preece, R. D.↗

High-Resolution Studies of Extreme-Ultraviolet Emission from CO by Electron Impact

We report a high-resolution study (0.0036 nm full width at half maximum) of electron-impact-induced emission spectra of CO at 30-, 75-, and 100-eV electron-impact energies. The spectral features were acquired in optically thin conditions. At the specified resolution, attainable with our 3-m vacuum ultraviolet spectrometer, we observe rotationally resolved emission bands of CO in the extreme ultraviolet, from the vibronic states B (sup 1)sigma(sup +)(0), C (sup 1)sigma(sup+)(0), and E (sup 1)pi(0), to the ground state X (sup 1)sigma(sup +)(0). A simple model of these bands, based on the Honl-London factors and the rotational constants, is constructed and is shown to be in good agreement with the observed spectra. The predissociation yield for the E (sup 1)pi electronic state has been determined, showing that the E state has the largest predissociation cross section of CO for all singlet-state Rydberg series members. The excitation function of the [E (sup 1)pi(0) yields X (sup 1)sigma(sup +)(0)] transition, in the 0-800-eV impact energy range, is measured, permitting determination of the oscillator strength by using a modified Born approximation analytical fit.

Ciocca, Marco↗

The Extreme Spin of the Black Hole in Cygnus X-1

The compact primary in the X-ray binary Cygnus X-1 was the first black hole to be established via dynamical observatIOns. We have recently determined accurate values for its mass and distance, and for the orbital inclination angle of the binary. Building on these.results, which are based on our favored (asynchronous) dynamical model, we have measured the radius of the inner edge of the black hole's accretion disk by fitting its thermal continuum.spectrum to a fully relativistic model of a thin accretion disk. Assuming that the spin axis of the black hole is aligned with the orbital angular momentum vector, we have determined that Cygnus X-I contains a near-extreme Kerr black hole with a spin parameter a* > 0.95 (3(sigma)). For a less probable (synchronous) dynamIcal model, we find a* > 0.92 (3(sigma)). In our analysis, we include the uncertainties in black hole mass orbital inclination angle and distance, and we also include the uncertainty in the calibration of the absolute flux via the Crab. These four sources of uncertainty totally dominate the error budget. The uncertainties introduced by the thin-disk model we employ are particularly small in this case given the extreme spin of the black hole and the disk's low luminosity.

Gou, Lijun↗

Shock compaction of molybdenum powder

Shock recovery experiments which were carried out in the 9 to 12 GPa range on 1.4 distension Mo and appear adequate to compact to full density ( 45 (SIGMA)m) powders were examined. The stress levels, however, are below those calculated to be from 100 to approx. 22 GPa which a frictional heating model predicts are required to consolidate approx. 10 to 50 (SIGMA)m particles. The model predicts that powders that have a distension of m=1.6 shock pressures of 14 to 72 GPa are required to consolidate Mo powders in the 50 to 10 (SIGMA)m range.

Ahrens, T. J.↗

On the performance of large Gaussian basis sets for the computation of total atomization energies

The total atomization energies of a number of molecules have been computed using an augmented coupled-cluster method and (5s4p3d2f1g) and 4s3p2d1f) atomic natural orbital (ANO) basis sets, as well as the correlation consistent valence triple zeta plus polarization (cc-pVTZ) correlation consistent valence quadrupole zeta plus polarization (cc-pVQZ) basis sets. The performance of ANO and correlation consistent basis sets is comparable throughout, although the latter can result in significant CPU time savings. Whereas the inclusion of g functions has significant effects on the computed Sigma D(e) values, chemical accuracy is still not reached for molecules involving multiple bonds. A Gaussian-1 (G) type correction lowers the error, but not much beyond the accuracy of the G1 model itself. Using separate corrections for sigma bonds, pi bonds, and valence pairs brings down the mean absolute error to less than 1 kcal/mol for the spdf basis sets, and about 0.5 kcal/mol for the spdfg basis sets. Some conclusions on the success of the Gaussian-1 and Gaussian-2 models are drawn.

Martin, J. M. L.↗

Sensitivity of a mesoscale model to initial specification of relative humidity, liquid water and vertical motion

The influence of synoptic scale initial conditions on the accuracy of mesoscale precipitation modeling is investigated. Attention is focused on the relative importance of the water vapor, cloud water, rain water, and vertical motion, with the analysis carried out using the Limited Area Mesoscale Prediction System (LAMPS). The fully moist primitive equation model has 15 levels and a terrain-following sigma coordinate system. A K-theory approach was implemented to model the planetary boundary layer. A total of 15 sensitivity simulations were run to investigate the effects of the synoptic initial conditions of the four atmospheric variables. The absence of synoptic cloud and rain water amounts in the initialization caused a 2 hr delay in the onset of precipitation. The delay was increased if synoptic-scale vertical motion was used instead of mesoscale values. Both the delays and a choice of a smoothed moisture field resulted in underestimations of the total rainfall.

Kalb, M. W.↗

The carbon isotope biogeochemistry of (epsilon)CO2 production in a methanogenic marine sediment

To investigate the relationship between sigma(CO2) delta(C-13) values and rates of the dominant remineralization processes at the organic-rich field site of Cape Lookout Bight, NC, the isotopic composition of porewater sigma(CO2) was measured on a seasonal basis. The sigma(CO2) delta(C-13) values varies seasonally in response to changes in rates of sulfate reduction and methanogenesis, the dominant remineralization processes at this site. A tube incubation experiment was also performed to determine the isotopic signature of the sigma(CO2) produced by sulfate reduction and methanogenesis. The delta(C-13) of the sigma(CO2) produced in the sulfate reduction zone determined from the tube incubation was -14.3 plus or minus 1.9, a value enriched in C-13 relative to the labile organic fraction. The C-13-enrichment may be caused by low rates of methanogenesis occurring in the sulfate reduction zone. The delta(C-13) of the sigma(CO2) produced in the methanogenic zone was estimated to be +44 per mil, whereas the co-produced methane was -65 per mil. The fractionation factor for CO2 reduction was calculated to be 1.055, a value in agreement with previous estimates at this site. The measured concentration and delta(C-13) of the sigma(CO2) at Cape Lookout was closely reproduced by a diagenetic model using the measured rates of sulfate reduction and sigma(CO2) production, and the isotopic signature of the sigma(CO2) production in the two biogeochemical zones.

Boehme, Susan E.↗

GPS tracking of TOPEX/POSEIDON: Results and implications

A reduced dynamic filtering strategy that exploits the unique geometric strength of the Global Positioning System (GPS) to minimize the effects of force model errors has yielded orbit solutions for TOPEX/POSEIDON which appear accurate to better than 3 cm (1 sigma) in the radial component. Reduction of model error also reduces the geographic correlation of the orbit error. With a traditional dynamic approach, GPS yields radial orbit accuracies of 4-5 cm, comparable to the accuracy delivered by satellite laser ranging and the Doppler orbitography and radio positioning integrated by satellite (DORIS) tracking system. A portion of the dynamic orbit error is in the Joint Gravity Model-2 (JGM-2); GPS data from TOPEX/POSEIDON can readily reveal that error and have been used to improve the gravity model.

Bertiger, W. I.↗

Three-dimensional baroclinic instability of a Hadley cell for small Richardson number

A three-dimensional, linear stability analysis of a baroclinic flow for Richardson number, Ri, of order unity is presented. The model considered is a thin horizontal, rotating fluid layer which is subjected to horizontal and vertical temperature gradients. The basic state is a Hadley cell which is a solution of the complete set of governing, nonlinear equations and contains both Ekman and thermal boundary layers adjacent to the rigid boundaries; it is given in a closed form. The stability analysis is also based on the complete set of equations; and perturbation possessing zonal, meridional, and vertical structures were considered. Numerical methods were developed for the stability problem which results in a stiff, eighth-order, ordinary differential eigenvalue problem. The previous work on three-dimensional baroclinic instability for small Ri was extended to a more realistic model involving the Prandtl number, sigma, and the Ekman number, E, and to finite growth rates and a wider range of the zonal wavenumber.

Antar, B. N.↗