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At least 703 records · Page 39

Separation of isobaric Amino Acids and Small Molecule Metabolites Using Multipass Ion Mobility Analysis

Amino acids along with small molecule metabolites are important biomarkers for the study and detection of diseases that are initially analyzed in untargeted omics fashion. Amino acids and many metabolites are isomeric, and their specific form can have a significant impact on biological function. Chromatographic separation of isomers is challenging, and they cannot be resolved by mass spectrometry alone. Ion mobility is a technique that allows the separation of ions based on their size, shape, and charge. Here we present the results of the separation of isobaric amino acids and small molecule metabolites using a system that allows for multi-pass ion mobility separation which, in turn, enhances the ion mobility resolution of the separation. Amino acid standards and small molecule metabolites commercially available were infused directly into a SELECT SERIES™ Cyclic™ IMS system. Solutions of individual and mixture of the isobaric species were used and the mobility conditions were optimized for multiple passes for each corresponding set of isobaric species. Both ionization polarities and various solvent adducts were tested to provide the best signal intensity and separation. Amino acids such as leucine and isoleucine have previously been separated with ion mobility in a system with lower ion mobility resolution (SYNAPT™ G2 mass spectrometer) rendering about 90% of valley and mobility resolution of around 40 Ω/ΔΩ. With the enhanced ion mobility resolution using the cyclic IMS technique we have obtained almost complete separation of those amino acids rendering a valley of about 10% after 15 passes. For this case, the mobility resolution is around 250 Ω/ΔΩ. Another example is the separation of glucose-6-phosphate from glucose-1-phosphate, and fructose-6phosphate which were separated after 10 passes. For this case, the mobility resolution is around 205 Ω/ΔΩ.

Hernando J Olivos↗

Time-History Statistics of Soot Formation in A Model Gas Turbine Combustor

Soot formation is a complex dynamic and intermittent process determined by properties of the fuel, combustor design, and combustor operation. Although the major steps in soot formation (i.e., formation of precursors, inception, growth and evolution) are similar for a variety of carbonaceous fuels, applications, and operating conditions, it remains unclear when the temporal transition between these steps occurs. An engineering prediction tool coupled with computational fluid physics (CFD), therefore needs to accurately model all these complex steps. To develop such a model, we propose the time-history concept for understanding the time dependency of soot formation as a function of local properties (i.e., temperature, velocity, local fuel air ratio, etc.). We continue our previous work with modeling the DLR aero-combustor [1] with our updated in-house CFD code, Open National Combustion Code (OpenNCC), that now includes a Multiple Time-Scale Flamelet Progress Variable approach and a the semi-empirical two-equation soot model. We injected massless tracer particles upstream of the injector region of the combustor to collect time-history statistics of the solution variables. The correlations between the collected statistics with respect to the experimental soot volume fraction data showed that time-history effect of certain flow variables, including turbulent kinetic energy (TKE), and multiple species is indeed important for soot formation. We then conducted a time-history based correlation analysis to determine the key species and the concentration ranges critical for soot formation (C6H5-based nucleation, acetylene-based surface growth, and oxidation with OH and O2). Based on the time-history correlation coefficient (THCC) analysis, we propose possible modifications to improve the current two-equation model.

LES↗

Multi-blocking strategies for the INS3D incompressible Navier-Stokes code

With the continuing development of bigger and faster supercomputers, computational fluid dynamics (CFD) has become a useful tool for real-world engineering design and analysis. However, the number of grid points necessary to resolve realistic flow fields numerically can easily exceed the memory capacity of available computers. In addition, geometric shapes of flow fields, such as those in the Space Shuttle Main Engine (SSME) power head, may be impossible to fill with continuous grids upon which to obtain numerical solutions to the equations of fluid motion. The solution to this dilemma is simply to decompose the computational domain into subblocks of manageable size. Computer codes that are single-block by construction can be modified to handle multiple blocks, but ad-hoc changes in the FORTRAN have to be made for each geometry treated. For engineering design and analysis, what is needed is generalization so that the blocking arrangement can be specified by the user. INS3D is a computer program for the solution of steady, incompressible flow problems. It is used frequently to solve engineering problems in the CFD Branch at Marshall Space Flight Center. INS3D uses an implicit solution algorithm and the concept of artificial compressibility to provide the necessary coupling between the pressure field and the velocity field. The development of generalized multi-block capability in INS3D is described.

Gatlin, Boyd↗

Transonic viscous and inviscid solutions using a composite velocity procedure

Solutions for transonic viscous and inviscid flows using a composite velocity procedure are presented. The velocity components of the compressible Navier-Stokes equations are written in terms of a multiplicative composite consisting of a viscous or rotational velocity and an inviscid, irrotational, potential like function. For viscous flows, the governing equations are solved using a coupled strongly implicit procedure and the outer inviscid flow corresponds to an irrotational, potential flow. Further investigation of the inviscid flow solution is made so that the correct rotational flow solution may be obtained for the transonic case. The Euler equations are solved for the inviscid flow calculations. Solutions to the full potential equation are recovered unless the axial momentum equation is written in full conservation form.

Gordnier, R. E.↗

Theory and Computation of Optimal Low- and Medium- Thrust Orbit Transfers

This report presents new theoretical results which lead to new algorithms for the computation of fuel-optimal multiple-burn orbit transfers of low and medium thrust. Theoretical results introduced herein show how to add burns to an optimal trajectory and show that the traditional set of necessary conditions may be replaced with a much simpler set of equations. Numerical results are presented to demonstrate the utility of the theoretical results and the new algorithms. Two indirect methods from the literature are shown to be effective for the optimal orbit transfer problem with relatively small numbers of burns. These methods are the Minimizing Boundary Condition Method (MBCM) and BOUNDSCO. Both of these methods make use of the first-order necessary conditions exactly as derived by optimal control theory. Perturbations due to Earth's oblateness and atmospheric drag are considered. These perturbations are of greatest interest for transfers that take place between low Earth orbit altitudes and geosynchronous orbit altitudes. Example extremal solutions including these effects and computed by the aforementioned methods are presented. An investigation is also made into a suboptimal multiple-burn guidance scheme. The FORTRAN code developed for this study has been collected together in a package named ORBPACK. ORBPACK's user manual is provided as an appendix to this report.

Goodson, Troy D.↗

Computation of optimal low- and medium-thrust orbit transfers

This paper presents the formulation of the optimal low- and medium-thrust orbit transfer control problem, numerical methods for solution, and numerical solutions of the problem. The problem formulation is for final mass maximization and allows for second-harmonic oblateness, atmospheric drag, and 3D noncoplanar nonaligned elliptic terminal orbits. We set up examples to demonstrate the ability of two indirect methods to solve the resulting two point boundary value problems (TPBVP). The methods demonstrated are the multiple point shooting method as formulated in Oberle's (1987) subroutine BOUNDSCO, and the minimizing boundary-condition method (MBCM). We find that although both methods can converge solutions, there are tradeoffs to using either method. We present numerical solutions of planar transfers in which both the initial orbit exit and final orbit entry points have been optimized. These solutions include two- and three-burn transfers. The methods used show an ability to handle thrust down to at least T/W(o) = O(10 exp -3). They also show similar convergence abilities with or without the oblateness and drag terms. We discuss the issue of maximizing with respect to the final time and provide evidence that implies a local optimum at a maximum final time for a given number of burns.

Chuang, C.-H.↗

Practical Aspects of Multiple-Input Design for Aircraft System Identification Flight Tests

Practical aspects of multiple-input design methods for aircraft system identification flight tests are discussed. The orthogonal optimized multisine multiple-input design technique is explained and demonstrated, along with useful variations. Practical implementation and application issues associated with applying orthogonal optimized multisine inputs in flight are explained, and solutions are demonstrated using flight data from full-scale and subscale aircraft, as well as simulated flight data from an F-16 nonlinear simulation. Topics include truncated and extended excitation inputs, variations for control effectors with limited movement capabilities, aircraft dynamic response to excitation inputs, pilot implementation, statistical uncertainty quantification, multiple-input efficiency and effectiveness, flight testing with active feedback control, frequency-response estimation, control actuator modeling, and control interaction effects. Examples demonstrate that the orthogonal optimized multisine input design method is a practical, versatile, and effective approach for designing multiple excitation inputs for aircraft system identification flight tests.

Multiple-Input Design↗

Argumentation for coordinating shared activities

an increasing need for space missions to be able to collaboratively (and competitively) develop plans both within and across missions. In addition, interacting spacecraft that interleave onboard planning and execution must reach consensus on their commitments to each other prior to execution. In domains where missions have varying degrees of interaction and different constraints on communication and computation, the missions will require different coordination protocols in order to efficiently reach consensus with in their imposed deadlines. We describe a Shared Activity Coordination (SHAC) framework that provides a decentralized algorithm for negotiating the scheduling of shared activities over the lifetimes of multiple agents and a foundation for customizing protocols for negotiating planner interactions. We investigate variations of a few simple protocols based on argumentation and distributed constraints satisfaction techniques and evaluate their abilities to reach consistent solutions according to computation, time, and communication costs in an abstract domain where spacecraft propose joint measurements.

Mars↗

Nearly two-dimensional solutions of Euler's equations

Motivated by a stretched version of the Taylor-Green initial-value problem for the Euler and Navier-Stokes equations, nearly two-dimensional incompressible flows are considered involving a single direction of slow spatial variation. A multiple-scale formulation of the problem leads by contour averaging to a system that determines the slow development in space and time. It is shown that the latter system is equivalent to an axisymmetric problem with nonstandard connection between circulation, cylindrical radius, and angular velocity component. Special solutions of the system in the exact axisymmetric case suggest that near-two-dimensionality is lost in finite time.

Childress, Stephen↗

Fixture for multiple-FCC chemical stripping and plating

For chemical stripping, lead tape applied near ends to be stripped protects insulation. Taped ends are submerged half way in stripping solution. For electroplating, both ends of FCC are stripped - top ends for electric contact, others for submersion in electroplating solution.

Angele, W.↗

A perturbation solution for transverse pressure-sensitive combustion instability in an annulus

A method for analysis of combustion instability in rocket motors based on a combination of the Galerkin method and the two-variable (or multiple-scales) perturbation method is developed. The method is illustrated by applying it to the problem of pressure-sensitive combustion instability in a liquid-fuel annular combustion chamber. To the order of approximation inherent in the method it is found that the complete linear stability analysis and most of the nonlinear stability analysis can be carried out in closed form. The results thus obtained are used to clarify several aspects of the interpretation of numerical solutions obtained by previous investigators.

Googerdy, A.↗

COMOC: a finite-element algorithm for the Navier-Stokes equations

Finite-element algorithm devised to facilitate solution of two-dimensional Navier-Stokes equations governing kinematics and thermodynamics of variable-viscosity, compressible, multiple-species fluid. Algorithm has been implemented into existing computer program system.

Baker, A. J.↗

Analytical study of mixing and reacting three-dimensional supersonic combustor flow fields

An analytical investigation is presented of mixing and reacting hydrogen jets injected from multiple orifices transverse and parallel to a supersonic airstream. The COMOC computer program, based upon a finite-element solution algorithm, was developed to solve the governing equations for three-dimensional, turbulent, reacting, boundary-region, and confined flow fields. The computational results provide a three-dimensional description of the velocity, temperature, and species-concentration fields downstream of hydrogen injection. Detailed comparisons between cold-flow data and results of the computational analysis have established validity of the turbulent-mixing model based on the elementary mixing-length hypothesis. A method is established to initiate computations for reacting flow fields based upon cold-flow correlations and the appropriate experimental parameters of Mach number, injector spacing, and pressure ratio. Key analytical observations on mixing and combustion efficiency for reacting flows are presented and discussed.

Baker, A. J.↗

Singular asymptotic expansions in nonlinear rotordynamics

During hot firing ground testing of the Space Shuttle's Main Engine, vibrations of the liquid oxygen pump occur at frequencies which cannot be explained by the linear Jeffcott model of the rotor. The model becomes nonlinear after accounting for deadband, side forces, and rubbing. Two phenomena present in the numerical solutions of the differential equations are unexpected periodic orbits of the rotor and tracking of the nonlinear frequency. A multiple scale asymptotic expansion of the differential equations is used to give an analytic explanation of these characteristics.

Day, W. B.↗

Singular asymptotic expansions in nonlinear rotordynamics

During hot firing ground testing of the Space shuttle's Main Engine, vibrations of the liquid oxygen pump occur at frequencies which cannot be explained by the linear Jeffcott model of the rotor. The model becomes nonlinear after accounting for deadband, side forces, and rubbing. Two phenomena present in the numerical solutions of the differential equations are unexpected periodic orbits of the rotor and tracking of the nonlinear frequency. A multiple scale asymptotic expansion of the differential equations is used to give an analytic explanation of these characteristics.

Day, W. B.↗

A design strategy for autonomous systems

Some solutions to crucial issues regarding the competent performance of an autonomously operating robot are identified; namely, that of handling multiple and variable data sources containing overlapping information and maintaining coherent operation while responding adequately to changes in the environment. Support for the ideas developed for the construction of such behavior are extracted from speculations in the study of cognitive psychology, an understanding of the behavior of controlled mechanisms, and the development of behavior-based robots in a few robot research laboratories. The validity of these ideas is supported by some simple simulation experiments in the field of mobile robot navigation and guidance.

Forster, Pete↗

A multiblock/multigrid Euler analysis of a propfan transport with wing-mounted nacelles, including slipstream effects

A multiblock/multigrid computation of the inviscid flow over a wing-mounted propfan transport with propwash is presented. An explicit multistage scheme drives the integral Euler equations to a steady state solution, while an actuator disk approximates the slipstream effects of the propfan blades. Practical applications of detailed surface gridding, multiple block field grids and multigrid convergence acceleration are demonstrated.

Nishida, Brian A.↗

A numerical method for phase-change problems

A highly accurate and efficient finite-difference method for phase-change problems with multiple moving boundaries of irregular shape is developed by employing a coordinate transformation that immobilizes moving boundaries and preserves the conservative forms of the original governing equations. The numerical method is first presented for one-dimensional phase-change problems (involving large density variation between phases, heat generation, and multiple moving boundaries) and then extended to solve two-dimensional problems (without change of densities between phases). Numerical solutions are obtained non-iteratively using an explicit treatment of the interfacial mass and energy balances and an implicit treatment of the temperature field equations. The accuracy and flexibility of the present numerical method are verified by solving some phase-change problems and comparing the results with existing analytical, semi-analytical and numerical solutions. Results indicate that one- and two-dimensional phase-change problems can be handled easily with excellent accuracies.

Kim, Charn-Jung↗