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At least 181 records · Page 10

Theoretical characterization of the potential energy surface for H + N2 yields HN2. II - Computed points to define a global potential

A previous calculation for H + N2 (Walch et al., 1989) focused on the minimum energy path (MEP) region of the potential energy surface and on estimates of the lifetime of the HN2 species. In this paper, energies computed at geometries selected to permit a global representation of the potential energy surface (PES) are reported. As in the previous work, the calculations were performed using the complete active space self-consistent field/externally contracted configuration interaction method. The surface was characterized using the same basis set as in the previous paper except that an improved contraction of the H s-basis is used. Calculations with a larger basis set were carried out along an approximate MEP obtained with the smaller basis set. The new PES exhibits a sharp curvature, which was not present in the previous calculations, and has a slightly narrower and smaller barrier to dissociation. Saddle points for H atom exchange via collinear and T shaped HN2 complexes are also reported.

Walch, Stephen P.↗

Computation of thermochemical nonequilibrium flows around a simple and a double ellipse

The nonequilibrium viscous reactive flows over a simple and a double ellipse at a 30 degree angle of attack were computed. The geometry and the free stream conditions are given by INRIA/GAMNI/SMAI workshop test cases 6.2-2 and 6.2-4. The governing Navier-Stokes equations coupled with thermochemical nonequilibrium processes are solved numerically using a fully coupled, implicit, finite volume technique with a dynamically adaptive grid. The nonequilibrium gas model and the numerical method used in the calculations are briefly described.

Gokcen, Tahir↗

Dynamic edge warping - An experimental system for recovering disparity maps in weakly constrained systems

Dynamic edge warping (DEW), a technique for recovering reasonably accurate disparity maps from uncalibrated stereo image pairs, is presented. No precise knowledge of the epipolar camera geometry is assumed. The technique is embedded in a system including structural stereopsis on the front end and robust estimation in digital photogrammetry on the other for the purpose of self-calibrating stereo image pairs. Once the relative camera orientation is known, the epipolar geometry is computed and the system can use this information to refine its representation of the object space. Such a system will find application in the autonomous extraction of terrain maps from stereo aerial photographs, for which camera position and orientation are unknown a priori, and for online autonomous calibration maintenance for robotic vision applications, in which the cameras are subject to vibration and other physical disturbances after calibration. This work thus forms a component of an intelligent system that begins with a pair of images and, having only vague knowledge of the conditions under which they were acquired, produces an accurate, dense, relative depth map. The resulting disparity map can also be used directly in some high-level applications involving qualitative scene analysis, spatial reasoning, and perceptual organization of the object space. The system as a whole substitutes high-level information and constraints for precise geometric knowledge in driving and constraining the early correspondence process.

Boyer, K. L.↗

Design of a hybrid laminar flow control nacelle

Consideration is given to the potential application of hybrid-laminar-flow control to the external surface of a modern, high-bypass-ratio (HBR) turbofan engine nacelle. With the advent of advanced ultra-HBR fans (with bypass ratios of 10-15), the wetted areas of these nacelles approach 10 percent of the total wetted area of future commercial transports. A hybrid-laminar-flow-control pressure distribution is specified and the corresponding nacelle geometry is computed utilizing a predictor/corrector design method. Linear stability calculations are conducted to provide predictions of the extent of the laminar boundary layer. Performance studies on an advanced twin-engine transport configuration are presented to determine potential benefits in terms of reduced fuel consumption.

Wie, Yong-Sun↗

Application of laminar flow control to high-bypass-ratio turbofan engine nacelles

Recently, the concept of the application of hybrid laminar flow to modern commercial transport aircraft was successfully flight tested on a Boeing 757 aircraft. In this limited demonstration, in which only part of the upper surface of the swept wing was designed for the attainment of laminar flow, significant local drag reduction was measured. This paper addresses the potential application of this technology to laminarize the external surface of large, modern turbofan engine nacelles which may comprise as much as 5-10 percent of the total wetted area of future commercial transports. A hybrid-laminar-flow-control (HLFC) pressure distribution is specified and the corresponding nacelle geometry is computed utilizing a predictor/corrector design method. Linear stability calculations are conducted to provide predictions of the extent of the laminar boundary layer. Performance studies are presented to determine potential benefits in terms of reduced fuel consumption.

Wie, Y. S.↗

Hybrid laminar flow control applied to advanced turbofan engine nacelles

The potential application of hybrid laminar flow control (HLFC) to the external surface of an advanced, high bypass ratio turbofan engine nacelle with a wetted area that approaches 15 percent of the wing total wetted area of future commercial transports is presented. A pressure distribution compatible with HLFC is specified and the corresponding nacelle geometry is computed employing a predictor/corrector design technique. Performance evaluations on an advanced twin-engine transport configuration are discussed to determine potential benefits in terms of reduced fuel consumption.

Collier, F. S., Jr.↗

Computation of thermochemical nonequilibrium flows around a simple and a double ellipse

The nonequilibrium viscous reactive flows over a simple and a double ellipse at a 30 degree angle of attack were computed. The geometry and the free stream conditions are given by INRIA/GAMNI/SMAI workshop test cases 6.2-2 and 6.2-4. The governing Navier-Stokes equations coupled with thermochemical nonequilibrium processes are solved numerically using a fully coupled, implicit, finite volume technique with a dynamically adaptive grid. The nonequilibrium gas model and the numerical method used in the calculations are briefly described.

Gokcen, Tahir↗

Free-wake computation of helicopter rotor flowfields in forward flight

A new method has been developed for computing advancing rotor flows. This method uses the Vorticity Embedding technique, which has been developed and validated over the last several years for hovering rotor problems. In this work, the unsteady full potential equation is solved on an Eulerian grid with an embedded vortical velocity field. This vortical velocity accounts for the influence of the wake. Dynamic grid changes that are required to accommodate prescribed blade motion and deformation are included using a novel grid blending method. Free wake computations have been performed on a two-bladed AH-1G rotor at low advance ratios including blade motion. Computed results are compared with experimental data. The sudden variations in airloads due to blade-vortex interactions on the advancing and retreating sides are well captured. The sensitivity of the computed solution to various factors like core size, time step and grids has been investigated. Computed wake geometries and their influence on the aerodynamic loads at these advance ratios are also discussed.

Ramachandran, K.↗

Time-Accurate Unsteady Flow Simulations Supporting the SRM T+68-Second Pressure Spike Anomaly Investigation (STS-54B)

Time-accurate unsteady flow simulations are being performed supporting the SRM T+68sec pressure 'spike' anomaly investigation. The anomaly occurred in the RH SRM during the STS-54 flight (STS-54B) but not in the LH SRM (STS-54A) causing a momentary thrust mismatch approaching the allowable limit at that time into the flight. Full-motor internal flow simulations using the USA-2D axisymmetric code are in progress for the nominal propellant burn-back geometry and flow conditions at T+68-sec--Pc = 630 psi, gamma = 1.1381, T(sub c) = 6200 R, perfect gas without aluminum particulate. In a cooperative effort with other investigation team members, CFD-derived pressure loading on the NBR and castable inhibitors was used iteratively to obtain nominal deformed geometry of each inhibitor, and the deformed (bent back) inhibitor geometry was entered into this model. Deformed geometry was computed using structural finite-element models. A solution for the unsteady flow has been obtained for the nominal flow conditions (existing prior to the occurrence of the anomaly) showing sustained standing pressure oscillations at nominally 14.5 Hz in the motor IL acoustic mode that flight and static test data confirm to be normally present at this time. Average mass flow discharged from the nozzle was confirmed to be the nominal expected (9550 lbm/sec). The local inlet boundary condition is being perturbed at the location of the presumed reconstructed anomaly as identified by interior ballistics performance specialist team members. A time variation in local mass flow is used to simulate sudden increase in burning area due to localized propellant grain cracks. The solution will proceed to develop a pressure rise (proportional to total mass flow rate change squared). The volume-filling time constant (equivalent to 0.5 Hz) comes into play in shaping the rise rate of the developing pressure 'spike' as it propagates at the speed of sound in both directions to the motor head end and nozzle. The objectives of the present analysis are to: (1) capture the dynamic responses of the motor combustion gas flow to correlate with available low-frequency (less than 12.5 sample/sec) data and (2) observe the high-frequency (up to 50 Hz) characteristics of the response to determine any potentials for dynamic coupling.

Dougherty, N. S.↗

Neural Net-Based Redesign of Transonic Turbines for Improved Unsteady Aerodynamic Performance

A recently developed neural net-based aerodynamic design procedure is used in the redesign of a transonic turbine stage to improve its unsteady aerodynamic performance. The redesign procedure used incorporates the advantages of both traditional response surface methodology (RSM) and neural networks by employing a strategy called parameter-based partitioning of the design space. Starting from the reference design, a sequence of response surfaces based on both neural networks and polynomial fits are constructed to traverse the design space in search of an optimal solution that exhibits improved unsteady performance. The procedure combines the power of neural networks and the economy of low-order polynomials (in terms of number of simulations required and network training requirements). A time-accurate, two-dimensional, Navier-Stokes solver is used to evaluate the various intermediate designs and provide inputs to the optimization procedure. The optimization procedure yields a modified design that improves the aerodynamic performance through small changes to the reference design geometry. The computed results demonstrate the capabilities of the neural net-based design procedure, and also show the tremendous advantages that can be gained by including high-fidelity unsteady simulations that capture the relevant flow physics in the design optimization process.

Madavan, Nateri K.↗

A Comparison of Density Functional Theory with Ab initio Approaches for Systems Involving First Transition Row Metals

Density functional theory (DFT) is found to give a better description of the geometries and vibrational frequencies of FeL and FeL(sup +) systems than second order Moller Plesset perturbation theory (MP2). Namely, the DFT correctly predicts the shift in the CO vibrational frequency between free CO and the Sigma(sup -) state of FeCO and yields a good result for the Fe-C distance in the quartet states of FeCH4(+) 4 These are properties where the MP2 results are unsatisfactory. Thus DFT appears to be an excellent approach for optimizing the geometries and computing the zero-point energies of systems containing first transition row atoms. Because the DFT approach is biased in favor of the 3d(exp 7) occupation, whereas the more traditional approaches are biased in favor of the 3d(exp 6) occupation, differences are found in the relative ordering of states. It is shown that if the dissociation is computed to the most appropriate atomic asymptote and corrected to the ground state asymptote using the experimental separations, the DFT results are in good agreement with high levels of theory. The energetics at the DFT level are much superior to the MP2 and in most cases in good agreement with high levels of theory.

Ricca, Alessandra↗

The Heats of Formation of GaCl3 and its Fragments

The heats of formation of GaC13 and its fragments are computed. The geometries and frequencies are obtained at the B3LYP level. The CCSD(T) approach is used to solve the correlation problem. The effect of Ga 3d correlation is studied, and found to affect the bond energies by up to 1 kcal/mol. Both basis set extrapolation and bond functions are considered as ways to approach the basis set limit. Spin-orbit and scalar relativistic effects are also considered.

Bauschlicher, Charles W., Jr.↗

Instability Wave–Streak Interactions in a High Mach Number Boundary Layer at Flight Conditions

The interaction of stationary streaks undergoing nonmodal growth with modally unstable instability waves in a hypersonic boundary-layer flow is studied using numerical computations. The geometry and flow conditions are selected to match a relevant trajectory location from the ascent phase of the HIFiRE-1 flight experiment; namely, a 7 degree half-angle, circular cone with 2.5 mm nose radius, freestream Mach number equal to 5.30, unit Reynolds number equal to 13.42 m -1 , and wall-to-adiabatic temperature ratio of approximately 0.35 over most of the vehicle. This paper investigates the nonlinear evolution of initially linear optimal disturbances that evolve into finite-amplitude streaks, followed by an analysis of the modal instability characteristics of the perturbed, streaky boundary-layer flow. The investigation is performed with stationary direct numerical simulations (DNS) and plane-marching parabolized stability equations (PSE), in conjunction with partial-differential-equation-based planar eigenvalue analysis. The overall effect of streaks is to reduce the peak amplification factors of instability waves, indicating a possible downstream shift in the onset of laminar-turbulent transition. The present study confirms previous findings that the mean flow distortion of the nonlinear streak perturbation reduces the amplification rates of the Mack-mode instability. More importantly, however, the present results demonstrate that the spanwise varying component of the streak can produce a larger effect on the Mack-mode amplification. The study with selected azimuthal wavenumbers for the stationary streaks reveals that a wavenumber of approximately 1.4 times larger than the optimal wavenumber is more effective in stabilizing the planar Mack-mode instabilities. In the absence of unstable first-mode waves for the present cold-wall condition, transition onset is expected to be delayed until the peak streak amplitude increases to nearly 35 percent of the freestream velocity, when intrinsic instabilities of the boundary-layer streaks begin to dominate the transition process. For streak amplitudes below that limit a significant net stabilization is achieved, yielding a potential transition delay that can exceed 100 percent of the length of the laminar region in the uncontrolled case.

Boundary layer stability↗

Transition Delay via Vortex Generators in a Hypersonic Boundary Layer at Flight Conditions

The potential of realizable, stationary streaks undergoing non-modal growth to stabilize a hypersonic boundary-layer flow and, subsequently, delay the laminar-turbulent transition onset, is studied via numerical computations. The geometry and flow conditions are selected to match a relevant trajectory location from the ascent phase of the HIFiRE-1 flight experiment, namely, a 7-degree half-angle cone with 2.5 mm nose radius, freestream Mach number of 5.30, freestream unit Reynolds number equal to 13.42 x 10(exp 6)/m, and wall-to-adiabatic temperature ratio of approximately 0.35 over most of the test article. This paper investigates flow modifications induced by wall-mounted vortex generators (VGs), followed by an analysis of the modal instability of the perturbed, streaky boundary-layer flow. Results are presented both for a single array of VGs that was designed on the basis of optimal growth theory and for a VG configuration involving two separate arrays with opposite orientations that ware designed to provide staged control of flow instabilities while simultaneously reducing the amplification of streak instabilities resulting from the control devices. Earlier research had shown that the onset of transition during the HIFiRE-1 flight experiment, which did not include any control devices, correlated with an amplification factor of N = 14.7 for the planar Mack modes. If one assumes that the transition N -factor is not affected by the introduction of the VGs, then the control configurations based on a single array of VGs and two separate arrays would result in a transition delay of 17% and 40%, respectively. These findings suggest a passive flow control s to induce streaks that would delay transition in hypersonic boundary dominated by Mack-mode instabilities.

Incompressible boundary layer↗

Detect-and-Avoid Maneuver Planning: Benefits of Including Route Recapture

Development of Detect-and-avoid (DAA) systems’ maneuver guidance requirements at RTCA has centered on tactical maneuvers away from the intruder. Recapturing the flight-plan route the initial maneuver is not directly taken into account by most DAA maneuver guidance algorithms. This work demonstrates potential challenges and inefficiencies that can arise in recapturing the route after resolving a conflict. Horizontal resolution trajectories for a test matrix of encounters with varying aircraft speeds and geometries are computed by minimizing either flight time or deviation to serve as a baseline. Turn directions computed from a reference DAA algorithm coupled with a pilot selection model and a second algorithm called Autoresolver (AR) are compared to these baseline resolution trajectories. Baseline results show that turning into the intruder yields favorable cost for most encounters. Additional analysis of pilot response data shows that only three-fourths of pilots’ horizontal maneuvers turn into intruders, a percentage much lower than the baseline results. Improvement to a DAA guidance algorithm based on findings in this work is discussed.

Route Recapture↗

Detect-and-Avoid Maneuver Planning: Benefits of Including Route Recapture

Development of Detect-and-avoid (DAA) systems’ maneuver guidance requirements at RTCA has centered on tactical maneuvers away from the intruder. Recapturing the flight-plan route the initial maneuver is not directly taken into account by most DAA maneuver guidance algorithms. This work demonstrates potential challenges and inefficiencies that can arise in recapturing the route after resolving a conflict. Horizontal resolution trajectories for a test matrix of encounters with varying aircraft speeds and geometries are computed by minimizing either flight time or deviation to serve as a baseline. Turn directions computed from a reference DAA algorithm coupled with a pilot selection model and a second algorithm called Autoresolver (AR) are compared to these baseline resolution trajectories. Baseline results show that turning into the intruder yields favorable cost for most encounters. Additional analysis of pilot response data shows that only three-fourths of pilots’ horizontal maneuvers turn into intruders, a percentage much lower than the baseline results. Improvement to a DAA guidance algorithm based on findings in this work is discussed.

Route Recapture↗