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All sourcesNASA NTRSDOE OSTI
NASA NTRS1993

Research activities at the Center for Modeling of Turbulence and Transition

The main research activities at the Center for Modeling of Turbulence and Transition (CMOTT) are described. The research objective of CMOTT is to improve and/or develop turbulence and transition models for propulsion systems. The flows of interest in propulsion systems can be both compressible and incompressible, three dimensional, bounded by complex wall geometries, chemically reacting, and involve 'bypass' transition. The most relevant turbulence and transition models for the above flows are one- and two-equation eddy viscosity models, Reynolds stress algebraic- and transport-equation models, pdf models, and multiple-scale models. All these models are classified as one-point closure schemes since only one-point (in time and space) turbulent correlations, such as second moments (Reynolds stresses and turbulent heat fluxes) and third moments, are involved. In computational fluid dynamics, all turbulent quantities are one-point correlations. Therefore, the study of one-point turbulent closure schemes is the focus of our turbulence research. However, other research, such as the renormalization group theory, the direct interaction approximation method, and numerical simulations are also pursued to support the development of turbulence modeling.

Shih, Tsan-Hsing↗
NASA NTRS1994

Center for modeling of turbulence and transition: Research briefs, 1993

This research brief contains the progress reports of the research staff of the Center for Modeling of Turbulence and Transition (CMOTT) from June 1992 to July 1993. It is also an annual report to the Institute for Computational Mechanics in Propulsion located at Ohio Aerospace Institute and NASA Lewis Research Center. The main objectives of the research activities at CMOTT are to develop, validate, and implement turbulence and transition models for flows of interest in propulsion systems. Currently, our research covers eddy viscosity one- and two-equation models, Reynolds-stress algebraic equation models, Reynolds-stress transport equation models, nonequilibrium multiple-scale models, bypass transition models, joint scalar probability density function models, and Renormalization Group Theory and Direct Interaction Approximation methods. Some numerical simulations (LES and DNS) have also been carried out to support the development of turbulence modeling. Last year was CMOTT's third year in operation. During this period, in addition to the above mentioned research, CMOTT has also hosted the following programs: an eighteen-hour short course on 'Turbulence--Fundamentals and Computational Modeling (Part I)' given by CMOTT at the NASA Lewis Research Center; a productive summer visitor research program that has generated many encouraging results; collaborative programs with industry customers to help improve their turbulent flow calculations for propulsion system designs; a biweekly CMOTT seminar series with speakers from within and without the NASA Lewis Research Center including foreign speakers. In addition, CMOTT members have been actively involved in the national and international turbulence research activities. The current CMOTT roster and organization are listed in Appendix A. Listed in Appendix B are the abstracts of the biweekly CMOTT seminar. Appendix C lists the papers contributed by CMOTT members.

Liou, William W.↗
NASA NTRS1993

Dynamic stall of an oscillating wing. Part 1: Evaluation of turbulence models

Unsteady flowfields of a two-dimensional oscillating wing are calculated using an implicit, finite-difference, Navier-Stokes numerical scheme using five widely used turbulence models. The objective of this study is to identify an appropriate turbulence model for accurate simulation of three-dimensional dynamic stall. Three unsteady flow conditions corresponding to attached flow, light-stall, and deep-stall of an oscillating wing experiment were chosen as test cases for computations. Results of unsteady airload hysteresis curves, harmonics of unsteady pressures, and instantaneous flow pictures are presented. Comparison of unsteady airloads with experiment show that all models are deficient in some sense and not a single model predicts all airloads consistently and in agreement with experiment for all flow conditions. For the attached flow condition, the Renormalization Group Theory (RNG), the Johnoson-King (J-K), and the Spalart-Allmaras (S-A) models have better performance. The Baldwin-Lomax (B-L) and the Baldwin-Barth (B-B) models fair poorly. At the light-stall condition, the results for the RNG, the J-K, and S-A models are in agreement with experiment for the upstroke but they all over predict the separation shown by the experiment and therefore have bigger hysteresis loops than experimental results. The B-B model results are also in good agreement for upstroke but have poor lift hysteresis for downstroke. It has superior drag and pitching-moment predictions. For deep-stall conditions, the airloads for the RNG, the B -B, and the S-A models have fair agreement with experiment, but the B-B model performed better at the extreme deep-stall condition. Overall, the RNG model provides significant improvement over the B-L model in all flow regimes with no additional computational cost. The Baldwin-Barth model is the most expensive of the models considered here, costing about 2.5 times that of the Baldwin-Lomax model. Finally, a brief discussion of the effects of grid density, time-step size, and numerical dissipation on the unsteady solutions are also presented.

Srinivasan, G. R.↗
NASA NTRS1995

Evaluation of Turbulence Models for Unsteady Flows of an Oscillating Airfoil

Unsteady flowfields of a two-dimensional oscillating airfoil are calculated using an implicit, finite-difference, Navier Stokes numerical scheme. Five widely used turbulence models are used with the numerical scheme to assess the accuracy and suitability of the models for simulating the retreating blade stall of helicopter rotor in forward flight. Three unsteady flow conditions corresponding to an essentially attached flow, light-stall, and deep-stall cases of an oscillating NACA 0015 wing experiment were chosen as test cases for computations. Results of unsteady airloads hysteresis curves, harmonics of unsteady pressures, and instantaneous flowfield patterns are presented. Some effects of grid density, time-step size, and numerical dissipation on the unsteady solutions relevant to the evaluation of turbulence models are examined. Comparison of unsteady airloads with experimental data show that all models tested are deficient in some sense and no single model predicts airloads consistently and in agreement with experiment for the three flow regimes. The chief findings are that the simple algebraic model based on the renormalization group theory (RNG) offers some improvement over the Baldwin Lomax model in all flow regimes with nearly same computational cost. The one-equation models provide significant improvement over the algebraic and the half-equation models but have their own limitations. The Baldwin-Barth model overpredicts separation and underpredicts reattachment. In contrast, the Spalart-Allmaras model underpredicts separation and overpredicts reattachment.

Srinivasan, G. R.↗
NASA NTRS1999

Measurements of Tc (Q,P): Depression of the Superfluid Transition Temperature by a Heat Current Along the Lambda Line

We report experimental measurements of Tc (Q,P) for heat currents (Q) between I1and 100 micro W/sq cm and pressure (P) between SVP and 15 bar. The measurements were performed in a normal gravity environment, using the low-gravity simulator facility at JPL without the magnet being energized. The sample pressure was controlled to 0.1 micro bar using a hot volume, and a Straty-Adams capacitive pressure gauge. The total volume of helium in the sample cell and the hot volume was held constant using a pneumatic low temperature valve. A melting curve thermometer (MCT) measured the transition temperature (Tc) with a resolution of about 10 nK through a sidewall probe of the thermal conductivity sample cell. We employed the same measurement technique and procedure described by DAS. Preliminary results indicate that Tc (Q,P) depends very little on the pressure in the pressure range between SVP and 15 bar with a variation in the amplitude of Tc(Q,P) of less than about 5% observable in this pressure range. According to the Renormalization-group theory calculation by Haussmann and Dohm, the amplitude of Tc (Q,P) has a leading pressure-dependence term proportional to xi(sub 0) (sup (1/nu)), where xi(sub 0) is the correlation-length amplitude and nu is the correlation-length exponent. Thus, a small pressure dependence of the amplitude of Tc (Q,P) is expected since xi(sub 0) is very weakly dependent on pressure between SVP and 15 bar, consistent with our measurements.

Liu, Yuan-Ming↗
NASA NTRS2000

Helium-4 Experiments near T-lambda in a Low-Gravity Simulator

We report our studies of gravity cancellation in a liquid helium sample cell along the lambda-line using a low-gravity simulator facility. The simulator consists of a superconducting magnet capable of producing B(delta-B/delta-z) = 22squareT)/cm. We have verified experimentally that the simulator can cancel gravity to about 0.01g in a cylindrical sample volume of 0.5 cm in diameter and 0.5 cm in height. This allows us to approach more closely the superfluid transition without entering the normal-superfluid two phase region induced by gravity. We also present the measurements of T-c(Q,P): depression of the superfluid transition temperature by a heat current(Q) along the lambda-line (P). The results are consistent with the Renormalization-group theory calculation. Measurements of thermal expansion coefficient in a heat current will also be discussed. The work has been carried out by JPL, California Institute of Technology under contract to NASA.

Liu, Yuanming↗
NASA NTRS2003

Measurement of the Specific Heat Using a Gravity Cancellation Approach

The specific heat at constant volume C(sob V) of a simple fluid diverges near its liquid-vapor critical point. However, gravity-induced density stratification due to the divergence of isothermal susceptibility hinders the direct comparison of the experimental data with the predictions of renormalization group theory. In the past, a microgravity environment has been considered essential to eliminate the density stratification. We propose to perform specific heat measurements of He-3 on the ground using a method to cancel the density stratification. A He-3 fluid layer will be heated from below, using the thermal expansion of the fluid to cancel the hydrostatic compression. A 6% density stratification at a reduced temperature of 10(exp -5) can be cancelled to better than 0.1% with a steady 1.7 micro K temperature difference across a 0.05 cm thick fluid layer. A conventional AC calorimetry technique will be used to determine the heat capacity. The minimized bulk density stratification with a relaxation time 6500 sec at a reduced temperature of 10(exp -5) will stay unchanged during 1 Hz AC heating. The smear of the specific heat divergence due to the temperature difference across the cell is about 0.1% at a reduced temperature of 10(exp -6). The combination of using High Resolution Thermometry with a 0.5 n K temperature resolution in the AC technique and the cancellation of the density stratification will enable C(sub V) to be measured down to a reduced temperature of 10(exp -6) with less than a 1% systematic error.

Zhong, Fang↗
NASA NTRS2005

A Study in HRT Resolution: Seeking Maximum Sensitivity Among Variations in Sensing Element Material

The EXACT (Experiments Along Coexistence near Tricriticality) project endeavors to perform the most rigorous test to date of Renormalization Group theory. In most cases, the theory gives only approximate solutions, but it offers exact predictions in the case of the He-3-He-4 tricritical point. Currently, the project is focused on maximizing the performance of the low-temperature system's HRT (high resolution thermometer) near the tricritical point. The HRT uses a PdMn sensing element, the qualities of which change based on its Mn concentration and whether or not it is annealed. All sensing element combinations will be catalogued, and through the data, the optimum configuration will be reported.

Morales, Jeremy M.↗
NASA NTRS2013

The Goal of the IAU/IAG Joint Working Group on the Theory of Earth Rotation

In 2012 the International Association of Geodesy (IAG) and the International Astronomical Union (IAU) initiated a process to establish a Joint Working Group (JWG) on theory of Earth rotation with the purpose of promoting the development of improved theories of the Earth rotation which reach the accuracy required to meet the needs of the near future as recommended by, e.g. GGOS, the Global Geodetic Observing System of the IAG. The JWG was approved by both organizations in April 2013 with the chairs being the two authors of this paper. Its structure comprises three Sub Working Groups (SWGs) addressing Precession/Nutation, Polar Motion and UT1, the Numerical Solutions and Validation, respectively. The SWGs should work in parallel for the sake of efficiency, but should keep consistency as an overall goal. This paper offers a view of the objectives and scope of the JWG and reports about its initial activities and plans.

Ferrandiz, J. M.↗
DOE OSTI2026

One-Step Relativistic Driven Similarity Renormalization Group Multireference Perturbation Theory

We present an efficient implementation of a one-step relativistic second-order multireference perturbation theory based on the multireference driven similarity renormalization group (MR-DSRG) using the exact two-component (X2C) Hamiltonian, which we denote X2C-DSRG-MRPT2. We show that the X2C-DSRG-MRPT2 method can accurately capture spin–orbit coupling (SOC) effects in the electronic structure of strongly correlated systems containing elements across the periodic table. We further demonstrate that the X2C-DSRG-MRPT2 method, through its variational treatment of SOC effects, can yield spin–orbit splittings with mean absolute percentage errors consistently below 7% with respect to experimental values for systems containing up to sixth row elements. With its modest computational scaling (fourth power in system size for the perturbative step) and high accuracy, X2C-DSRG-MRPT2 provides a promising avenue for the routine treatment of relativistic effects in strongly correlated molecular systems.

Hamiltonians↗
NASA NTRS1990

Dynamical theory of dense groups of galaxies

It is well known that galaxies associate in groups and clusters. Perhaps 40% of all galaxies are found in groups of 4 to 20 galaxies (e.g., Tully 1987). Although most groups appear to be so loose that the galaxy interactions within them ought to be insignificant, the apparently densest groups, known as compact groups appear so dense when seen in projection onto the plane of the sky that their members often overlap. These groups thus appear as dense as the cores of rich clusters. The most popular catalog of compact groups, compiled by Hickson (1982), includes isolation among its selection critera. Therefore, in comparison with the cores of rich clusters, Hickson's compact groups (HCGs) appear to be the densest isolated regions in the Universe (in galaxies per unit volume), and thus provide in principle a clean laboratory for studying the competition of very strong gravitational interactions. The $64,000 question here is then: Are compact groups really bound systems as dense as they appear? If dense groups indeed exist, then one expects that each of the dynamical processes leading to the interaction of their member galaxies should be greatly enhanced. This leads us to the questions: How stable are dense groups? How do they form? And the related question, fascinating to any theorist: What dynamical processes predominate in dense groups of galaxies? If HCGs are not bound dense systems, but instead 1D change alignments (Mamon 1986, 1987; Walke & Mamon 1989) or 3D transient cores (Rose 1979) within larger looser systems of galaxies, then the relevant question is: How frequent are chance configurations within loose groups? Here, the author answers these last four questions after comparing in some detail the methods used and the results obtained in the different studies of dense groups.

Mamon, Gary A.↗
DOE OSTI2025

Electronic structure theory with molecular point group symmetries on quantum annealers

Quantum computation has the potential to revolutionize quantum chemistry through major speedups in computation times and an exponential reduction in computational resources. Here, we combine the symmetry-adapted Jordan–Wigner encoding based on the full Boolean symmetry group $\mathbb{Z}$$^{k}_{2}$ with our new implementation of the Xia–Bian–Kais (XBK) method for improving the efficiency of electronic structure theory calculations on quantum annealers, particularly by reducing the number of qubits needed to achieve the same accuracy. By providing a more extensive symmetry-adapted encoding (SAE) than previous work, we are able to simulate molecules larger than those previously reported that have been studied using methods developed for quantum annealers and without using an active space. We calculated the potential energy surfaces of H 2 , LiH, He 2 , H 2 O, O 2 , N 2 , Li 2 , F 2 , CO, BH 3 , NH 3 , and CH 4 , with the largest molecule in the STO-6G basis set requiring 16 qubits with our SAE, and compared them with full configuration interaction results. The application of SAE to the XBK method provides an exponential reduction in the size of the Hilbert space and scales well with the size of the problem. It does not introduce significant additional errors for even or large values of a key variational parameter that determines the number of ancilla qubits used in the XBK method’s Hamiltonian embedding, or for certain molecules such as He 2 and H 2 O. Here, we provide an explanation for this behavior and a recommendation on the usage of our method. In addition, we briefly discuss the potential of extracting electronic excited states from our method.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2024

On a class of selection rules without group actions in field theory and string theory

We discuss a class of selection rules which i) do not come from group actions on fields, ii) are exact at tree level in perturbation theory, iii) are increasingly violated as the loop order is raised, and iv) eventually reduce to selection rules associated with an ordinary group symmetry. We start from basic field-theoretical examples in which fields are labeled by conjugacy classes rather than representations of a group, and discuss generalizations using fusion algebras or hypergroups. We also discuss how such selection rules arise naturally in string theory, such as for non-Abelian orbifolds or other cases with non-invertible worldsheet symmetries.

Kaidi, Justin (ORCID:0000000161440729)↗
DOE OSTI2024

Exploring the Links between Structural Distortions, Orbital Ordering, and Multipolar Magnetic Ordering in Double Perovskites Containing Re(VI) and Os(VII)

A combination of high-resolution powder diffraction techniques and solid-state NMR has been employed to explore the links between crystal structure, orbital ordering, and magnetism in three isostructural double perovskites containing transition metal ions with a 5d 1 configuration. In Ba 2 ZnReO 6 , both neutron and synchrotron X-ray powder diffraction data reveal a cubic-to-tetragonal transition at 23 K that breaks the degeneracy of the t 2g orbitals and leads to a pattern of orbital ordering that stabilizes magnetic ordering when the sample is cooled below 16 K. Similar behavior is observed in Ba 2 MgReO 6 , with an orbital ordering temperature of 33 K and a magnetic ordering temperature of 18 K. Prior theoretical works suggest that the pattern of orbital order seen in the P42/mnm space group is needed to stabilize the heavily canted antiferromagnetism of these compounds. Unfortunately, powder diffraction data is not sensitive enough to differentiate between the I4/mmm and P42/mnm structural models, as the distortions are too subtle to be unambiguously identified from either neutron or synchrotron X-ray powder diffraction methods. In contrast, both diffraction and 7 Li NMR data indicate that Ba 2 LiOsO 6 retains the cubic structure down to 1.7 K. The antiferromagnetic ground state and lack of any sign of orbital ordering in Ba 2 LiOsO 6 provide compelling evidence that the electronically driven tetragonal distortion seen in Ba2ZnReO6, and Ba2MgReO6 is intimately linked to the magnetic ordering seen in those compounds. The absence of magnetic reflections in high intensity neutron powder diffraction data collected on Ba 2 MgReO 6 strongly suggests ordering of multipolar moments on Re(VI), likely ferro-octupolar ordering.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Loop-string-hadron approach to SU(3) lattice Yang-Mills theory: Hilbert space of a trivalent vertex

The construction of gauge-invariant states of SU(3) lattice gauge theories has garnered new interest in recent years, but implementing them is complicated by the need for SU(3) Clebsch-Gordon coefficients. In the loop-string-hadron (LSH) approach to lattice gauge theories, the elementary excitations are strictly gauge invariant, and constructing the basis requires no knowledge of Clebsch-Gordon coefficients. Originally developed for SU(2), the LSH formulation was recently generalized to SU(3), but limited to one spatial dimension. In this work, we generalize the LSH approach to constructing the basis of SU(3) gauge-invariant states at a trivalent vertex—the essential building block to multidimensional space. A direct generalization from the SU(2) vertex yields a legitimate basis; however, in certain sectors of the Hilbert space, the naive LSH basis vectors so defined suffer from being nonorthogonal. The issues with orthogonality are directly related to the “missing label” or “outer multiplicity” problem associated with SU(3) tensor products and may also be phrased in terms of Littlewood-Richardson coefficients or the need for a “seventh Casimir” operator. The states that are unaffected by the problem are orthonormalized in closed form. For the sectors that are afflicted, we discuss the nonorthogonal bases and their orthogonalization. A few candidates for seventh Casimir operators are readily constructed from the suite of LSH gauge-singlet operators. The diagonalization of a seventh Casimir represents one prescriptive solution toward obtaining a complete orthonormal basis, but a closed-form general solution remains to be found. Published by the American Physical Society 2025

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗