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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 415 records · Page 23
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

DOE WPTO FY2021 Seedling End Report: Coupling Soil-Foundation Models to MHK Device Dynamic Models to Tighten the Design Envelope

The purpose of this Seedling project is to couple a marine renewable energy (MRE) dynamics simulation software with the soil-foundation models in the OC6 Phase II project [Bergua et al., 2021] and evaluate the software’s performance. This is a first step to accurately evaluating soil-foundation impacts on other types of MRE, like wave or current energy converters (WECs, CECs). OC6 Phase II compares offshore wind turbine (OWT) simulations using several different soil-foundation models to identify and fill key gaps in soil-foundation analyses. WEC-Sim was chosen to model the OC6 Phase II offshore wind turbine and various load cases because of its adaptability, accuracy of hydrodynamic loads, and ability to apply an arbitrary wind loading. Of the four methods used in OC6, the apparent fixity soil-foundation method was coupled with WEC-Sim. Technical challenges with flexible hydrodynamic bodies, added mass and external function libraries inhibited the ability to compare the WEC-Sim results to other OC6 participants. These challenges required that the WEC-Sim model of the OC6 OWT use a combination of rigid and flexible bodies to ensure a numerically stable solution. The rigid monopile creates a more stiff system and causes smaller amplitude motion under hydrodynamic loading and higher dominant frequency of motion under wind loading. These discrepancies are expected based on the increased stiffness of the WEC-Sim case.

16 TIDAL AND WAVE POWER↗
NASA NTRS1972

Riding and handling qualities of light aircraft: A review and analysis

Design procedures and supporting data necessary for configuring light aircraft to obtain desired responses to pilot commands and gusts are presented. The procedures employ specializations of modern military and jet transport practice where these provide an improvement over earlier practice. General criteria for riding and handling qualities are discussed in terms of the airframe dynamics. Methods available in the literature for calculating the coefficients required for a linearized analysis of the airframe dynamics are reviewed in detail. The review also treats the relation of spin and stall to airframe geometry. Root locus analysis is used to indicate the sensitivity of airframe dynamics to variations in individual stability derivatives and to variations in geometric parameters. Computer programs are given for finding the frequencies, damping ratios, and time constants of all rigid body modes and for generating time histories of aircraft motions in response to control inputs. Appendices are included presenting the derivation of the linearized equations of motion; the stability derivatives; the transfer functions; approximate solutions for the frequency, damping ratio, and time constants; an indication of methods to be used when linear analysis is inadequate; sample calculations; and an explanation of the use of root locus diagrams and Bode plots.

Smetana, F. O.↗
NASA NTRS1975

Propagation of high amplitude higher order sounds in slightly soft rectangular ducts, carrying mean flow

The resonance expansion method, developed to study the propagation of sound in rigid rectangular ducts is applied to the case of slightly soft ducts. Expressions for the generation and decay of various harmonics are obtained. The effect of wall admittance is seen through a dissipation function in the system of nonlinear differential equations, governing the generation of harmonics. As the wall admittance increases, the resonance is reduced. For a given wall admittance this phenomenon is stronger at higher input intensities. Both the first and second order solutions are obtained and the results are extended to the case of ducts having mean flow.

Wang, K. S.↗
NASA NTRS1985

Some Aspects of Attitude Stability of Tethered Space Stations

The stability of attitude motion of space stations composed by platforms connected tethers is studied. The motion is assumed to be three dimensional and the station rigid. First, the well known linearized theory is adopted and the location of different configurations in the stability chart is found; second, a destabilizing feature of finite amplitude motion is outlined as a function of inertia parameters.

Bergamasui, S.↗
NASA NTRS1995

Manual for a workstation-based generic flight simulation program (LaRCsim), version 1.4

LaRCsim is a set of ANSI C routines that implement a full set of equations of motion for a rigid-body aircraft in atmospheric and low-earth orbital flight, suitable for pilot-in-the-loop simulations on a workstation-class computer. All six rigid-body degrees of freedom are modeled. The modules provided include calculations of the typical aircraft rigid-body simulation variables, earth geodesy, gravity and atmospheric models, and support several data recording options. Features/limitations of the current version include English units of measure, a 1962 atmosphere model in cubic spline function lookup form, ranging from sea level to 75,000 feet, rotating oblate spheroidal earth model, with aircraft C.G. coordinates in both geocentric and geodetic axes. Angular integrations are done using quaternion state variables Vehicle X-Z symmetry is assumed.

Jackson, E. Bruce↗
DOE OSTI2022

Physics makes the difference: Bayesian optimization and active learning via augmented Gaussian process

Abstract Both experimental and computational methods for the exploration of structure, functionality, and properties of materials often necessitate the search across broad parameter spaces to discover optimal experimental conditions and regions of interest in the image space or parameter space of computational models. The direct grid search of the parameter space tends to be extremely time-consuming, leading to the development of strategies balancing exploration of unknown parameter spaces and exploitation towards required performance metrics. However, classical Bayesian optimization (BO) strategies based on the Gaussian process (GP) do not readily allow for the incorporation of the known physical behaviors or past knowledge. Here we explore a hybrid optimization/exploration algorithm created by augmenting the standard GP with a structured probabilistic model of the expected system’s behavior. This approach balances the flexibility of the non-parametric GP approach with a rigid structure of physical knowledge encoded into the parametric model. The fully Bayesian treatment of the latter allows additional control over the optimization via the selection of priors for the model parameters. The method is demonstrated for a noisy version of a standard univariate test function used to evaluate optimization algorithms and further extended to physical lattice models. This methodology is expected to be universally suitable for injecting prior knowledge in the form of physical models and past data in the BO framework.

42 ENGINEERING↗
DOE OSTI2024

Multiscale Modeling of Vinyl-Addition Polynorbornenes: The Effect of Stereochemistry

Vinyl-addition polynorbornenes are candidates for designing high-performance polymers due to unique characteristics, which include a high glass transition temperature associated with a rigid backbone. Recent studies have established that the processability and properties of these polymers can be fine-tuned by using targeted substitutions. However, synthesis with different catalysts results in materials with distinct properties, potentially due to the presence of various stereoisomers that are difficult to quantify experimentally. Herein, we develop all-atom models of polynorbornene oligomers based on classical force fields and density functional theory. To establish the relationship between chemical architecture, chain conformations, and melt structure, we perform detailed molecular dynamics simulations with the fine-tuned atomistic force field and propose simpler coarse-grained descriptions to address the high molecular weight limit. All-atom simulations of oligomers suggest high glass transition temperatures in the range of 550–600 K. In the melt state (800 K), meso chains form highly rigid extended coils (C∞≈11) with amorphous structural characteristics similar to the X-ray diffraction data observed in the literature. In contrast, simulations with racemo chains predict highly helical tubular chain conformations that could promote assembly into crystalline structures.

Polymer Science↗
DOE OSTI2018

Low-Dimensional and Multi-Dimensional Pendulums in Nonconservative Fields. Part 2

In this review, we discuss new cases of integrable systems on the tangent bundles of finite-dimensional spheres. Such systems appear in the dynamics of multidimensional rigid bodies in non-conservative fields. These problems are described by systems with variable dissipation with zero mean. We found several new cases of integrability of equations of motion in terms of transcendental functions (in the sense of the classification of singularities) that can be expressed as finite combinations of elementary functions.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2025

Comparing Classical and Machine Learning Force Fields for Modeling Deformation of Metal–Organic Frameworks Relevant for Direct Air Capture

Deformation of metal–organic frameworks (MOFs) induced by adsorbate molecules can affect adsorption properties such as capacity and selectivity, but most computational studies of MOFs assume framework rigidity to simplify calculations. Although flexible force fields (FFs) for MOFs have been parametrized for specific materials, the generality of FFs for reliably modeling adsorbate-induced deformation to accuracy nearing that of density functional theory (DFT) has not been established. This work confirms using DFT calculations that adsorbate-induced deformation can affect CO 2 and H 2 O adsorption energies in a considerable fraction of MOFs promising for direct air capture (DAC). We then benchmark the efficacy of several general-purpose FFs in describing adsorbate-induced deformation for DAC against DFT. Our results show that current classical FFs are insufficient for describing MOF deformation, especially in cases of interest for DAC where strong interactions exist between adsorbed molecules and MOF frameworks. Some emerging machine learning force fields (MLFFs) we tested, particularly CHGNet, MACE-MP-0, and Equiformer V2, appear to be more promising than the classical FF for emulating the deformation behavior described by DFT. The best performing FF (CHGNet), however, fails to achieve the accuracy required for practical predictions with a mean absolute adsorption energy error of 0.124 eV.

adsorption↗
DOE OSTI2020

Improved reference system for the corrected rigid spheres equation of state model

The Corrected Rigid Spheres (CRIS) EOS model, developed from fluid perturbation theory using a hard sphere reference system, has been successfully used to calculate the EOS of many materials, including gases and metals. The radial distribution function (RDF) plays a pivotal role in choosing the sphere diameter, through a variational principle, as well as the thermodynamic response. Despite its success, the CRIS model has some shortcomings in that it predicts too large a temperature for liquid-vapor critical points, can break down at large compression, and is computationally expensive. In this paper, we first demonstrate that an improved analytic representation of the hard sphere RDF does not alleviate these issues. Relaxing the strict adherence of the RDF to hard spheres allows an accurate fit to the isotherms and vapor dome of the Lennard-Jones fluid using an arbitrary reference system. Second order correction are eliminated, limiting the breakdown at large compression and significantly reducing the computation cost. The transferrability of the new model to real systems is demonstrated on argon, with an improved vapor dome compared to the original CRIS model.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
NASA NTRS1976

Adaptation of a general circulation model to ocean dynamics

A primitive-variable general circulation model of the ocean was formulated in which fast external gravity waves are suppressed with rigid-lid surface constraint pressires which also provide a means for simulating the effects of large-scale free-surface topography. The surface pressure method is simpler to apply than the conventional stream function models, and the resulting model can be applied to both global ocean and limited region situations. Strengths and weaknesses of the model are also presented.

Turner, R. E.↗
NASA NTRS1977

Theory of the rotation of the rigid earth

Equations of motion for a triaxial rigid earth are derived in Andoyer variables. The reference plane is the ecliptic of date which is moving as a result of planetary perturbations. By using this noninertial system, the development of the disturbing function for the sun and moon is simplified, with an additional term appearing in the Hamiltonian which, however, contributes only to precessional motion. The nutation terms derived are compared with those of Woolard.

Kinoshita, H.↗
NASA NTRS1977

NASTRAN finite element idealization study

The investigation of the effects of variations of mesh refinement and mesh pattern were conducted using a basic rectangular mesh pattern. When employing the constant strain TRMEM element, the basic rectangular pattern was subdivided into triangles. This subdivision employs two different triangular patterns and allows results to be obtained which demonstrate the effect of modelling bias. Errors in tip deflection, direct stress, and shearing stress as a function of mesh size and element aspect ratio were obtained as well as mid-span stress distributions. All problems were solved on an IBM 360/95 computer using MacNeal-Schwendler Version MSC-38 Rigid Format-1 of the NASTRAN computer program. While NASTRAN uses double precision arithmetic for the solution of the global equations for displacements, subsequent computations to obtain element stresses are carried out in single precision. This suggests that some improvement in stress recovery might be expected when using the higher precision DCD machines.

Case, W. R.↗
NASA NTRS1983

Control - Demands mushroom as station grows

The NASA space station, which is presently in the planning stage, is to be composed of both rigid and nonrigid modules, rotating elements, and flexible appendages subjected to environmental disturbances from the earth's atmospheric gravity gradient, and magnetic field, as well as solar radiation and self-generated disturbances. Control functions, which will originally include attitude control, docking and berthing control, and system monitoring and management, will with evolving mission objectives come to encompass such control functions as articulation control, autonomous navigation, space traffic control, and large space structure control. Attention is given to the advancements in modular, distributed, and adaptive control methods, as well as system identification and hardware fault tolerance techniques, which will be required.

Szirmay, S. Z.↗
NASA NTRS1990

Influence of atmospherically induced random wave fronts on diffraction imagery - A computer simulation model for testing image reconstruction algorithms

This paper is devoted to the development of a two-dimensional computer-simulation model that is based on the rigid constraints of optical diffraction theory with careful attention paid to the generation of sample realizations of Gaussian-distributed, spatially random, isotropic wave fronts that have zero-mean and prescribed-covariance functions. Given a sample realization of the wave front, the corresponding centered point-spread function and optical-transfer function are evaluated. A detailed study is made of the statistics of random wave-front tilt, point-spread function, modulus squared of transfer function, and phase of transfer function.

Barakat, Richard↗
NASA NTRS1993

The cosmic-ray He-3/He-4 ratio from 100 to 1600 MeV/amu

The Superconducting Magnet Instrument for Light Isotopes (SMILI) flew for 19 hours on September 1, 1989, with a residual overburden of 5 g/sq cm. It measured the charge, rigidity, and velocity of 30,000 cosmic-ray helium nuclei, with velocity determined by time-of-flight and Cerenkov techniques. Using these data, the flux and isotopic composition of helium as a function of energy were determined. The observed isotopic composition is consistent with that expected from interstellar propagation models inferred from the secondaries of CNO, in contrast to earlier observations which indicated an overabundance of He-3. We discuss constraints that this result places on cosmic-ray transport and solar modulation models.

Beatty, J. J.↗
NASA NTRS1993

The SCR Ne-21 and Ar-38 in lunar rock 68815: The solar proton energy spectrum over the past 2 MYR

We determined concentration profiles of Ne-21, Ne-22, and Ar-38 produced by solar protons as a function of depth in oriented lunar rock 68815. A comparison with model predictions indicate a solar proton flux J(4(pi)(r); E greater than 10 MeV) of 100-125 p/sq. cm/s and a rigidity, R sub 0, of 85-100 MV, assuming an erosion rate of 1-2 mm/Myr. These results for 68815 and similar results on 61016 define the integrated solar proton energy spectrum at the moon over the past approximately 2 Myr.

Garrison, D. H.↗