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At least 991 records · Page 55

Bond length, dipole moment, and harmonic frequency of CO

A detailed comparison of some properties of CO is given, at the modified coupled-pair functional, single and double excitation coupled-cluster (CCSD), and CCSD(T) levels of theory (including a perturbational estimate for connected triple excitations), using a variety of basis sets. With very large one-particle basis sets, the CCSD(T) method gives excellent results for the bond distance, dipole moment, and harmonic frequency of CO. In a (6s 5p 4d 3f 2g 1h) + (1s 1p 1d) basis set, the bond distance is about 0.005a0 too large, the dipole moment about 0.005 a.u. too small, and the frequency about 6/cm too small, when compared with experimental results.

Barnes, Leslie A.↗

A finite-element-based perturbation model for the rotordynamic analysis of shrouded pump impellers: Part 2: User's guide

This report describes the computational steps involved in executing a finite-element-based perturbation model for computing the rotor dynamic coefficients of a shrouded pump impeller or a simple seal. These arise from the fluid/rotor interaction in the clearance gap. In addition to the sample cases, the computational procedure also applies to a separate category of problems referred to as the 'seal-like' category. The problem, in this case, concerns a shrouded impeller, with the exception that the secondary, or leakage, passage is totally isolated from the primary-flow passage. The difference between this and the pump problem is that the former is analytically of the simple 'seal-like' configuration, with two (inlet and exit) flow-permeable stations, while the latter constitutes a double-entry / double-discharge flow problem. In all cases, the problem is that of a rotor clearance gap. The problem here is that of a rotor excitation in the form of a cylindrical whirl around the housing centerline for a smooth annular seal. In its centered operation mode, the rotor is assumed to give rise to an axisymmetric flow field in the clearance gap. As a result, problems involving longitudinal or helical grooves, in the rotor or housing surfaces, go beyond the code capabilities. Discarding, for the moment, the pre- and post-processing phases, the bulk of the computational procedure consists of two main steps. The first is aimed at producing the axisymmetric 'zeroth-order' flow solution in the given flow domain. Detailed description of this problem, including the flow-governing equations, turbulence closure, boundary conditions, and the finite-element formulation, was covered by Baskharone and Hensel. The second main step is where the perturbation model is implemented, with the input being the centered-rotor 'zeroth-order' flow solution and a prescribed whirl frequency ratio (whirl frequency divided by the impeller speed). The computational domain, in the latter case, is treated as three dimensional, with the number of computational planes in the circumferential direction being specified a priori. The reader is reminded that the deformations in the finite elements are all infinitesimally small because the rotor eccentricity itself is a virtual displacement. This explains why we have generically termed the perturbation model the 'virtually' deformable finite-element category. The primary outcome of implementing the perturbation model is the tangential and radial components, F(sub theta)(sup *) and F(sub r)(sup *) of the fluid-exerted force on the rotor surface due to the whirling motion. Repetitive execution of the perturbation model subprogram over a sufficient range of whirl frequency ratios, and subsequent interpolation of these fluid forces, using the least-square method, finally enable the user to compute the impeller rotor dynamic coefficients of the fluid/rotor interaction. These are the direct and cross-coupled stiffness, damping, and inertia effects of the fluid/rotor interaction.

Baskharone, Erian A.↗

Local area analysis of high-degree solar oscillations: New ring fitting procedures

The local area analysis of five-minute solar oscillations using ring diagrams to determine subphotospheric velocity flows is a tool for convection zone dynamics. In relation to the problem of the large computational task of fitting the rings, a faster method is presented that carries out the ring fitting using data obtained with a high l helioseismometer. Noise sources are eliminated, and a perturbation approach is used to fit the azimuthally averaged spectrum. The parameters determined in this way are held constant while the ring diagram is fitted. The results obtained are presented and discussed.

Haber, Deborah A.↗

Multi-Flight-Phase GPS Navigation Filter Applications to Terrestrial Vehicle Navigation and Positioning

A candidate onboard space navigation filter demonstrated excellent performance (less than 8 meter level RMS semi-major axis accuracy) in performing orbit determination of a low-Earth orbit Explorer satellite using single-frequency real GPS data. This performance is significantly better than predicted by other simulation studies using dual-frequency GPS data. The study results revealed the significance of two new modeling approaches evaluated in the work. One approach introduces a single-frequency ionospheric correction through pseudo-range and phase range averaging implementation. The other approach demonstrates a precise axis-dependent characterization of dynamic sample space uncertainty to compute a more accurate Kalman filter gain. Additionally, this navigation filter demonstrates a flexibility to accommodate both perturbational dynamic and observational biases required for multi-flight phase and inhomogeneous application environments. This paper reviews the potential application of these methods and the filter structure to terrestrial vehicle and positioning applications. Both the single-frequency ionospheric correction method and the axis-dependent state noise modeling approach offer valuable contributions in cost and accuracy improvements for terrestrial GPS receivers. With a modular design approach to either 'plug-in' or 'unplug' various force models, this multi-flight phase navigation filter design structure also provides a versatile GPS navigation software engine for both atmospheric and exo-atmospheric navigation or positioning use, thereby streamlining the flight phase or application-dependent software requirements. Thus, a standardized GPS navigation software engine that can reduce the development and maintenance cost of commercial GPS receivers is now possible.

Park, Young W.↗

Effect of Negative Ions on the Conductivity of the Titan Atmosphere

In an earlier paper, Borucki et al (1987) calculated the electrical conductivity and electrical charge on aerosols in Titan's atmosphere due to the ionization by galactic cosmic rays and electron precipitation from Saturn's magnetosphere. The lower atmosphere was predicted to be substantially more conducting than the atmospheres of Earth and Venus because of the high concentration of free electrons. The prediction of a high conductivity is based on the lack of electrophillic species which form negative ions with low mobility and which reduce the number of free electrons. At that time, no molecular species capable of forming negative ions in concentrations sufficient to perturb the atmospheric conductivity were identified. Recently, E. Bakes and her colleagues have been investigating the formation of nitrogenous macromolecules using quantum mechanical methods. Their calculations indicate that the molecules will be highly electrophillic and are likely to be present in the atmosphere at mixing ratios of order 10(exp -7). This mixing ratio is sufficiently large that a substantial reduction in the conductivity is expected at altitudes below 100 km. Revision of the atmospheric model to accommodate the presence of negative ions and to increase the fidelity of the modeling will be described.

Borucki, W. J.↗

Weight and the Future of Space Flight Hardware Cost Modeling

Weight has been used as the primary input variable for cost estimating almost as long as there have been parametric cost models. While there are good reasons for using weight, serious limitations exist. These limitations have been addressed by multi-variable equations and trend analysis in models such as NAFCOM, PRICE, and SEER; however, these models have not be able to address the significant time lags that can occur between the development of similar space flight hardware systems. These time lags make the cost analyst's job difficult because insufficient data exists to perform trend analysis, and the current set of parametric models are not well suited to accommodating process improvements in space flight hardware design, development, build and test. As a result, people of good faith can have serious disagreement over the cost for new systems. To address these shortcomings, new cost modeling approaches are needed. The most promising approach is process based (sometimes called activity) costing. Developing process based models will require a detailed understanding of the functions required to produce space flight hardware combined with innovative approaches to estimating the necessary resources. Particularly challenging will be the lack of data at the process level. One method for developing a model is to combine notional algorithms with a discrete event simulation and model changes to the total cost as perturbations to the program are introduced. Despite these challenges, the potential benefits are such that efforts should be focused on developing process based cost models.

Prince, Frank A.↗

The Design of the Reference Orbit for NISAR, the NASA-ISRO Synthetic Aperture Radar Mission

The NISAR mission plans to use a 12-day-repeating sun-synchronous orbit for repeat-pass interferometry at multiple time scales using SAR data. For the interferometry to work the radar measurements must be made from within a critical baseline, which happens if all of the orbits are maintained to be within a fixed tube around a reference orbit. This paper describes the choice of dynamical models used in defining such a reference orbit, the perturbative effects of dynamics not considered in the repeat orbit, and the process of designing the orbit to repeat. We also describe our method for sharing the repeat orbit among multiple mission participants who use different models and software.

Hatch, Sara J.↗

The Design of the Reference Orbit for NISAR, the NASA-ISRO Synthetic Aperture Radar Mission

The NISAR mission plans to use a 12-day-repeating sun-synchronous orbit for repeat-pass interferometry at multiple time scales using SAR data. For the interferometry to work the radar measurements must be made from within a critical baseline, which happens if all of the orbits are maintained to be within a fixed tube around a reference orbit. This paper describes the choice of dynamical models used in defining such a reference orbit, the perturbative effects of dynamics not considered in the repeat orbit, and the process of designing the orbit to repeat. We also describe our method for sharing the repeat orbit among multiple mission participants who use different models and software.

Hatch, Sara J.↗

Nonlinear Nonmodal Analysis of Hypersonic Flow over Blunt Cones

The linear amplification of modal disturbances that lead to boundary-layer transition in two-dimensional/axisymmetric hypersonic configurations is strongly reduced by the presence of a blunt nosetip, and the mechanisms underlying the observed onset of transition over the cone frustum are currently unknown. Linear nonmodal analysis has shown that both planar and oblique traveling disturbances that peak within the entropy layer experience appreciable energy amplification for moderate to large nosetip bluntness. The present study extends the previous linear analysis by including the nonlinear effects. Specifically, the perturbation form of the 2D, harmonic Navier-Stokes equations (HNSE) are solved with a fully implicit formulation and the Newton-Raphson method. The increased number of degrees of freedom for the nonlinear system presents difficulties for solution strategies based on direct solution of the linearized system. Such difficulties are overcome by using the GMRES iterative method with a preconditioner corresponding to a simplified Jacobian without the cross derivative terms. The HNSE solver is verified by comparing with nonlinear parabolized stability equation (NPSE) results for the nonlinear evolution of planar waves in an incompressible Blasius boundary layer and in a Mach 6 flow over a blunt cone. Finally, nonlinear nonmodal results are presented for planar traveling disturbances over the blunt cone. The nonmodal analysis demonstrates that entropy-layer disturbances generated close to the nose tip can seed the amplification of higher frequency Mack’s second-mode instabilities further downstream.

boundary layer transition↗

Nonlinear Nonmodal Analysis of Hypersonic Flow over Blunt Cones

The linear amplification of modal disturbances that lead to boundary-layer transition in two-dimensional/axisymmetric hypersonic configurations is strongly reduced by the presence of a blunt nosetip, and the mechanisms underlying the observed onset of transition over the cone frustum are currently unknown. Linear nonmodal analysis has shown that both planar and oblique traveling disturbances that peak within the entropy layer experience appreciable energy amplification for moderate to large nosetip bluntness. The present study extends the previous linear analysis by including the nonlinear effects. Specifically, the perturbation form of the 2D, harmonic Navier-Stokes equations (HNSE) are solved with a fully implicit formulation and the Newton-Raphson method. The increased number of degrees of freedom for the nonlinear system presents difficulties for solution strategies based on direct solution of the linearized system. Such difficulties are overcome by using the GMRES iterative method with a preconditioner corresponding to a simplified Jacobian without the cross derivative terms. The HNSE solver is verified by comparing with nonlinear parabolized stability equation (NPSE) results for the nonlinear evolution of planar waves in an incompressible Blasius boundary layer and in a Mach 6 flow over a blunt cone. Finally, nonlinear nonmodal results are presented for planar traveling disturbances over the blunt cone. The nonmodal analysis demonstrates that entropy-layer disturbances generated close to the nose tip can seed the amplification of higher frequency Mack’s second-mode instabilities further downstream.

boundary layer transition↗

Relativistic and Correlation Effects in CuH, AgH and AuH: Comparison of Various Relativistic Methods

The effects of relativity on the bond lengths, dissociation energies, and harmonic vibrational frequencies of the 1Epsilon(+) electronic ground states of the group IB hydrides CuH, AgH and AuH have been evaluated with a variety of ab initio methods. These properties were investigated with moderately-sized basis sets at the self-consistent field Hartree Fock (SCF HF) level and with second-order Moller-Plesset (MP2) perturbation theory for electron correlation. Comparisons were made between all-electron results using the nonrelativistic Hamiltonian, perturbation theory (PT) at first-order with only the one-electron non-fine structure terms of the Breit-Pauli Hamiltonian, the spin-free Douglas-Kroll (DK) transformed Dirac Hamiltonian and the untransformed Dirac Hamiltonian, and results using two sets of relativistic effective core potentials (RECPs). The expected trends of bond length decrease, dissociation energy increase and harmonic frequency increase with both relativity and correlation are found. Both sets of RECPs are shown to give good results, if accompanied by a reasonable basis set. The DK method is demonstrated to be an inexpensive, reliable approximation to the DHF method.

Collins, Charlene L.↗

A finite difference method for the solution of the transonic flow around harmonically oscillating wings

A finite difference method for the solution of the transonic flow about a harmonically oscillating wing is presented. The partial differential equation for the unsteady transonic flow was linearized by dividing the flow into separate steady and unsteady perturbation velocity potentials and by assuming small amplitudes of harmonic oscillation. The resulting linear differential equation is of mixed type, being elliptic or hyperbolic whereever the steady flow equation is elliptic or hyperbolic. Central differences were used for all derivatives except at supersonic points where backward differencing was used for the streamwise direction. Detailed formulas and procedures are described in sufficient detail for programming on high speed computers. To test the method, the problem of the oscillating flap on a NACA 64A006 airfoil was programmed. The numerical procedure was found to be stable and convergent even in regions of local supersonic flow with shocks.

Ehlers, E. F.↗

Semiclassical theory of unimolecular dissociation induced by a laser field

A semiclassical nonperturbative theory of direct photodissociation in a laser field is developed in which photon absorption and dissociation are treated in a unified fashion. This is achieved by visualizing nuclear dynamics as a representative particle moving on electronic-field surfaces. Methods are described for calculating dissociation rates and probabilities by Monte Carlo selection of initial conditions and integration of classical trajectories on these surfaces. This unified theory reduces to the golden rule expression in the weak-field and short-time limits, and predicts nonlinear behavior, i.e., breakdown of the golden rule expression in intense fields. Field strengths above which lowest-order perturbation theory fails to work have been estimated for some systems. Useful physical insights provided by the electronic-field representation have been illustrated. Intense field effects are discussed which are amenable to experimental observation. The semiclassical methods used here are also applicable to multiple-surface dynamics in fieldfree unimolecular and bimolecular reactions.

Yuan, J.-M.↗

Post-Newtonian gravitational bremsstrahlung

Formulas and numerical results for the gravitational radiation emitted during a low-deflection encounter between two massive bodies are presented. The results are valid through post-Newtonian order within general relativity. The gravitational waveform (transverse-traceless part of the metric perturbation tensor), the total luminosity and total emitted energy, the angular distribution of emitted energy (antenna pattern), and the frequency spectrum are discussed. A method of boosting the accuracy of these quantities to post-3/2-Newtonian order is presented. A numerical comparison of the results with previously reported results shows that the post-Newtonian method is reliable to better than 0.1% at v = 0.1c, to a few percent at v = 0.35c, and to 10-20% at v = 0.5c.

Turner, M.↗

On orbital fitting with altimeter data

Using altimeter data from a single pass, orbital fiting of these data is investigated. The stability problems of this special kind of short are method as well as the problem in the case of a mean Keplerian ellipse are discussed in detail. It is shown that short periodic perturbations can influence the size of the eccentricity of the satellite orbit computed from these data. In this way the desired result, the corrections of d zeta to the geoidal undulations, may be falsified.

Lelgemann, D.↗

Estimating Liquid And Gas Contents In A Tank

General approach to estimation of amounts of liquid and gas in tank based on measurements of pressure perturbations and temperatures and use of thermodynamic relationships among pressures, temperatures, and volumes. Although approach approximate and indirect, advantageous where such direct and precise methods as observation of stationary liquid/gas interface in gravitational field cannot be used. Used in presence or absence of gravitation or acceleration, and regardless of numbers, shapes, and movements of liquid/gas interfaces in tank. Also useful where liquid stationary but too hazardous to permit direct observation. Implemented in variety of ways, depending on type of liquid and conditions of operation and design of tank system.

Walter, Richard T.↗

Optimal guidance law development for an advanced launch system

A regular perturbation analysis is presented. Closed-loop simulations were performed with a first order correction including all of the atmospheric terms. In addition, a method was developed for independently checking the accuracy of the analysis and the rather extensive programming required to implement the complete first order correction with all of the aerodynamic effects included. This amounted to developing an equivalent Hamiltonian computed from the first order analysis. A second order correction was also completed for the neglected spherical Earth and back-pressure effects. Finally, an analysis was begun on a method for dealing with control inequality constraints. The results on including higher order corrections do show some improvement for this application; however, it is not known at this stage if significant improvement will result when the aerodynamic forces are included. The weak formulation for solving optimal problems was extended in order to account for state inequality constraints. The formulation was tested on three example problems and numerical results were compared to the exact solutions. Development of a general purpose computational environment for the solution of a large class of optimal control problems is under way. An example, along with the necessary input and the output, is given.

Calise, Anthony J.↗