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Results for “stabilizer states”

Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 235 records · Page 13
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Early Detection of Li-Ion Battery Thermal Runaway Using Commercial Diagnostic Technologies

The rate of electric vehicle (EV) adoption, powered by the Li-ion battery, has grown exponentially; largely driven by technological advancements, consumer demand, and global initiatives to reduce carbon emissions. As a result, it is imperative to understand the state of stability (SoS) of the cells inside an EV battery pack. That understanding will enable the warning of or prevention against catastrophic failures that can lead to serious injury or even, loss of life. The present work explores rapid electrochemical impedance spectroscopy (EIS) coupled with gas sensing technology as diagnostics to monitor cells and packs for failure markers. These failure markers can then be used for onboard assessment of SoS. Experimental results explore key changes in single cells and packs undergoing thermal or electrical abuse. Rapid EIS showed longer warning times, followed by VOC sensors, and then H 2 sensors. While rapid EIS gives the longest warning time, with the failure marker often appearing before the cell vents, the reliability of identifying impedance changes in single cells within a pack decreases as the pack complexity increases. This provides empirical evidence to support the significant role that cell packaging and battery engineering intricacies play in monitoring the SoS.

25 ENERGY STORAGE↗
DOE OSTI2023

New structures of Class II Fructose-1,6-Bisphosphatase from Francisella tularensis provide a framework for a novel catalytic mechanism for the entire class

Class II Fructose-1,6-bisphosphatases (FBPaseII) (EC: 3.1.3.11) are highly conserved essential enzymes in the gluconeogenic pathway of microorganisms. Previous crystallographic studies of FBPasesII provided insights into various inactivated states of the enzyme in different species. Presented here is the first crystal structure of FBPaseII in an active state, solved for the enzyme from Francisella tularensis (FtFBPaseII), containing native metal cofactor Mn 2+ and complexed with catalytic product fructose-6-phosphate (F6P). Another crystal structure of the same enzyme complex is presented in the inactivated state due to the structural changes introduced by crystal packing. Analysis of the interatomic distances among the substrate, product, and divalent metal cations in the catalytic centers of the enzyme led to a revision of the catalytic mechanism suggested previously for class II FBPases. We propose that phosphate-1 is cleaved from the substrate fructose-1,6-bisphosphate (F1,6BP) by T89 in a proximal α-helix backbone (G88-T89-T90-I91-T92-S93-K94) in which the substrate transition state is stabilized by the positive dipole of the $\langle$-helix backbone. Once cleaved a water molecule found in the active site liberates the inorganic phosphate from T89 completing the catalytic mechanism. Additionally, a crystal structure of Mycobacterium tuberculosis FBPaseII (MtFBPaseII) containing a bound F1,6BP is presented to further support the substrate binding and novel catalytic mechanism suggested for this class of enzymes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Understanding Spin Coherence in Polyoxometalate-Based Molecular Qubits

This research advances the understanding of spin decoherence mechanisms and addresses the grand challenges in quantum information science of generating and stabilizing quantum states that may be manipulated with single-atom precision. It is accomplished using unique capabilities developed at PNNL for ion soft landing and spatially resolved vibrational spectroscopy of well-defined supported molecular qubit (MQ) arrays. It addresses knowledge gaps impeding the development of MQ-based quantum devices by answering two scientific questions: 1) Can we minimize spin-lattice relaxation rates by tuning the substrate-MQ interface? 2) What is the optimum number of spin centers that enables sufficient coherent signal generation prior to decoherence through inter-MQ and MQ-support interactions? The objective is to develop predictive design principles for prolonging spin coherence lifetimes in arrays of optically-addressable MQs for quantum computing applications.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2025

Ab Initio Molecular Dynamics Insights into Stress Corrosion Cracking and Dissolution of Metal Oxides

Oxide phases such as α-Fe2O3 (hematite) and α-Al2O3 (corundum) are highly insoluble in water; however, subcritical crack growth has been observed in humidity nonetheless. Chemically induced bond breaking at the crack tip appears unlikely due to sterically hindered molecular transport. The molecular mechanics of a crack in corundum with a reactive force field reveal minimal lattice trapping, leading to bond breaking before sufficient space opens for water transport. To address this, we model a pre-built blunt crack with space for H2O molecule adsorption at the tip and show that it reduces fracture toughness by lowering the critical J-integral. Then, we explore stress-enhanced dissolution to understand the mechanism of crack tip blunting in the oxide/water system. Density functional theory combined with metadynamics was employed to describe atomic dissolution from flat hematite and corundum surfaces in pure water. Strain accelerates dissolution, stabilizing intermediate states with broken bonds before full atom detachment, while the free energy profile of unstrained surfaces is almost monotonic. The atomistic calculations provided input for a kinetic model, predicting the shape evolution of a blunt crack tip, which displays three distinct regimes: (i) dissolution primarily away from the tip, (ii) enhanced blunting near but not at the apex, and (iii) sharpening near the apex. The transition between regimes occurs at a low strain, highlighting the critical role of water in the subcritical crack growth of oxide scales, with dissolution as the fundamental microscopic mechanism behind this process.

Chemistry↗
NASA NTRS1973

Nonlinear transient analysis of multi-mass flexible rotors - theory and applications

The equations of motion necessary to compute the transient response of multi-mass flexible rotors are formulated to include unbalance, rotor acceleration, and flexible damped nonlinear bearing stations. A method of calculating the unbalance response of flexible rotors from a modified Myklestad-Prohl technique is discussed in connection with the method of solution for the transient response. Several special cases of simplified rotor-bearing systems are presented and analyzed for steady-state response, stability, and transient behavior. These simplified rotor models produce extensive design information necessary to insure stable performance to elastic mounted rotor-bearing systems under varying levels and forms of excitation. The nonlinear journal bearing force expressions derived from the short bearing approximation are utilized in the study of the stability and transient response of the floating bush squeeze damper support system. Both rigid and flexible rotor models are studied, and results indicate that the stability of flexible rotors supported by journal bearings can be greatly improved by the use of squeeze damper supports. Results from linearized stability studies of flexible rotors indicate that a tuned support system can greatly improve the performance of the units from the standpoint of unbalanced response and impact loading. Extensive stability and design charts may be readily produced for given rotor specifications by the computer codes presented in this analysis.

Kirk, R. G.↗
NASA NTRS1974

Mariner Mars 1971 inertial reference unit

The design concept of an inertial reference unit is reported that uses the gyroscope in a rate mode in conjunction with a unique application of a drift compensated and temperature stabilized solid state integrator for the inertial mode. A typical test program and results for an inertial reference unit as applied to the Mariner Mars 1971 program to achieve highly reliable spacecraft operation are also described.

Starks, G. T.↗
NASA NTRS1978

Fission origin of the moon - Cause and timing

A new scenario is offered for the origin of the moon. It is assumed that the earth formed initially with about the maximum amount of angular momentum consistent with dynamical stability. This state is approximated by the secularly unstable Maclaurin spheroids (highly flattened hamburger-shaped bodies). It is shown that the earth cannot depart from this state at a reasonable rate as long as its viscosity is in the range of liquid rock. Since core formation supplies about 1600 kJ/kg, the earth will not leave this state until core formation is complete. When cooling produces a rise in viscosity, the earth will necessarily evolve along a path which is approximated by the Riemann ellipsoids (which have rapid internal motion). The evolution is toward a Jacobi ellipsoid, but it is intercepted by the development of a third-harmonic (pear-shaped) instability, which is catastrophic and leads to fission. The process of fission itself may be fundamentally analogous to the breaking of a wave in water. We cannot exclude the possibility that some other planets evolved similarly.

Okeefe, J. A.↗
NASA NTRS1978

Dynamic analysis of flexible rotor-bearing systems using a modal approach

The generalized dynamic equations of motion were obtained by the direct stiffness method for multimass flexible rotor-bearing systems. The direct solution of the equations of motion is illustrated on a simple 3-mass system. For complex rotor-bearing systems, the direct solution of the equations becomes very difficult. The transformation of the equations of motion into modal coordinates can greatly simplify the computation for the solution. The use of undamped and damped system mode shapes in the transformation are discussed. A set of undamped critical speed modes is used to transform the equations of motion into a set of coupled modal equations of motion. A rapid procedure for computing stability, steady state unbalance response, and transient response of the rotor-bearing system is presented. Examples of the application of this modal approach are presented. The dynamics of the system is further investigated with frequency spectrum analysis of the transient response.

Choy, K. C.↗
NASA NTRS1983

The evolution equations for Taylor vortices in the small gap limit

The centrifugal instability of the viscous fluid flow between concentric circular cylinders in the small gap limit is considered. The amplitude of the Taylor vortex is allowed to depend on a slow time variable, a slow axial variable, and the polar angle. It is shown that the amplitude of the vortex cannot in general be described by a single amplitude equation. However, if the axial variations are periodic a single amplitude equation can be derived. In the absence of any slow axial variations it is shown that a Taylor vortex remains stable to wavy vortex perturbations. Furthermore, in this situation, stable nonaxisymmetric modes can occur but do not bifurcate from the Taylor vortex state. The stability of these modes is shown to be governed by a modified form of the Eckhaus criterion.

Hall, P.↗
NASA NTRS1984

Evolution equations for Taylor vortices in the small-gap limit

The centrifugal instability of the viscous fluid flow between concentric circular cylinders in the small gap limit is considered. The amplitude of the Taylor vortex is allowed to depend on a slow time variable, a slow axial variable, and the polar angle. It is shown that the amplitude of the vortex cannot in general be described by a single amplitude equation. However, if the axial variations are periodic a single amplitude equation can be derived. In the absence of any slow axial variations it is shown that a Taylor vortex remains stable to wavy vortex perturbations. Furthermore, in this situation, stable nonaxisymmeric modes can occur but do not bifurcate from the Taylor vortex state. The stability of these modes is shown to be governed by a modified form of the Eckhaus criterion. Previously announced in STAR as N84-10501

Hall, P.↗
NASA NTRS1986

A comparison of methods for DPLL loop filter design

Four design methodologies for loop filters for a class of digital phase-locked loops (DPLLs) are presented. The first design maps an optimum analog filter into the digital domain; the second approach designs a filter that minimizes in discrete time weighted combination of the variance of the phase error due to noise and the sum square of the deterministic phase error component; the third method uses Kalman filter estimation theory to design a filter composed of a least squares fading memory estimator and a predictor. The last design relies on classical theory, including rules for the design of compensators. Linear analysis is used throughout the article to compare different designs, and includes stability, steady state performance and transient behavior of the loops. Design methodology is not critical when the loop update rate can be made high relative to loop bandwidth, as the performance approaches that of continuous time. For low update rates, however, the miminization method is significantly superior to the other methods.

Aguirre, S.↗
NASA NTRS1985

Structural and aeroelastic analysis of the SR-7L propfan

A structural and aeroelastic analysis of a large scale advanced turboprop rotor blade is presented. This 8-blade rotor is designed to operate at Mach 0.8 at an altitude of 35,000 ft. The blades are highly swept and twisted and of spar/shell construction. Due to the complexity of the blade geometry and its high performance, it is subjected to much higher loads and tends to be much less stable than conventional blades. Four specific analyses were conducted: (1) steady deflection; (2) natural frequencies and mode shapes; (3) steady stresses; and (4) aeroelastic stability. State-of-the-art methods were used to analyze the blades including a large deflection, finite element structural analysis, and an aeroelastic analysis including interblade aerodynamic coupling (cascade effects). The study found the blade to be structurally sound and aeroelastically stable. However, it clearly indicated that advanced turboprop blades are much less robust than conventional blades and must be analyzed and fabricated much more carefully in order to assure that they are structurally sound and aeroelastically stable.

Hirschbein, Murray↗
NASA NTRS1987

Mutual interactions of redox couples via electron exchange in silicate melts - Models for geochemical melt systems

The mutual interactions via electron exchange of redox couples in glass-forming melts were investigated both theoretically and experimentally. A thermodynamic approach for considering the mutual interactions leads to conclusion that the degree of mutual interaction in the melt should be proportional in part to the difference in relative reduction potentials of the interacting redox couples. Experimental studies verify this conclusion for numerous redox couples in several composition/temperature/oxygen fugacity regimes. Geochemical systems simultaneously possess many potentially multivalent elements; the stabilized redox states in the resulting magmas can be explained in part by mutual interactions and by redox buffering through the central Fe(III)- Fe(II) couples in the melts. The significance of these results for basaltic magmas of the earth, moon, and meteorites is addressed.

Schreiber, Henry D.↗
NASA NTRS1988

Advancements in frequency-domain methods for rotorcraft system identification

A new method for frequency-domain identification of rotorcraft dynamics is presented. Nonparametric frequency-response identification and parametric tranfer-function modeling methods are extended to allow the extraction of state-space (stability and control derivative) representations. An interactive computer program DERIVID is described for the iterative solution of the multi-input/multi-output frequency-response matching approach used in the identification. Theoretical accuracy methods are used to determine the appropriate model structure and degree-of-confidence in the identified parameters. The method is applied to XV-15 tilt-rotor aircraft data in hover. Bare-airframe stability and control derivatives for the lateral/directional dynamics are shown to compare favorably with models previously obtained using time-domain identification methods and the XV-15 simulation program.

Tischler, Mark B.↗
NASA NTRS1988

A sufficient condition for the stability of conservative gyroscopic systems

A sufficient condition for the stability of conservative gyroscopic systems with negative definite stiffness is presented. The conditions for stability are stated in terms of the definiteness of certain combinations of the coefficient matrices of the equations of motion. These conditions yield design constraints in terms of the physical parameters of the system. An example is given to illustrate the correctness of the results, as well as to provide a comparison with the results of other researchers.

Inman, D. J.↗
NASA NTRS1989

Advancements in frequency-domain methods for rotorcraft system identification

A new method for frequency-domain identification of rotorcraft dynamics is presented. Nonparametric frequency-response identification and parametric transfer-function modeling methods are extended to allow the extraction of state-space (stability and control derivative) representations. An interactive computer program DERIVID is described for the iterative solution of the multi-input/multi-output frequency-response matching approach used in the identification. Theoretical accuracy methods are used to determine the appropriate model structure and degree-of-confidence in the identified parameters. The method is applied to XV-15 tilt-rotor aircraft data in hover. Bare-airframe stability and control derivatives for the lateral/directional dynamics are shown to compare favorably with models previously obtained using time-domain identification methods and the XV-15 simulation program.

Tischler, Mark B.↗