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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 109 records · Page 6
All sourcesNASA NTRSDOE OSTI
NASA NTRS1987

Users of middle atmosphere models remarks

The procedure followed for shuttle operations is to calculate descent trajectories for each potential shuttle landing site using the Global Reference Atmosphere Model (GRAM) to interactively compute density along the flight path 100 times to bound the statistics. The purpose is to analyze the flight dynamics, along with calculations of heat loads during reentry. The analysis program makes use of the modified version of the Jacchia-70 atmosphere, which includes He bulges over the poles and seasonal latitude variations at lower altitudes. For the troposphere, the 4-D Model is used up to 20 km, Groves from 30 km up to 90 km. It is extrapolated over the globe and faired into the Jacchia atmosphere between 90 and 115 km. Since data on the Southern Hemisphere was lacking, what was done was that the data was flipped over and lagged 6 months. Sometimes when winds are calculated from pressure data in the model there appear to be discontinuities. Modelers indicated that the GRAM was not designed to produce winds, but good wind data is needed for the landing phase of shuttle operations. Use of atmospheric models during reentry is one application where it is obvious that a single integrated atmosphere model is required.

Gamble, Joe↗
NASA NTRS1992

A catchment scale water balance model for FIFE

A catchment scale water balance model is presented and used to predict evaporation from the King's Creek catchment at the First ISLSCP Field Experiment site on the Konza Prairie, Kansas. The model incorporates spatial variability in topography, soils, and precipitation to compute the land surface hydrologic fluxes. A network of 20 rain gages was employed to measure rainfall across the catchment in the summer of 1987. These data were spatially interpolated and used to drive the model during storm periods. During interstorm periods the model was driven by the estimated potential evaporation, which was calculated using net radiation data collected at site 2. Model-computed evaporation is compared to that observed, both at site 2 (grid location 1916-BRS) and the catchment scale, for the simulation period from June 1 to October 9, 1987.

Famiglietti, J. S.↗
NASA NTRS1991

Calculations of hadronic dissociation of 28Si projectiles at 14.6A GeV by nucleon emission

An optical potential abrasion-ablation collision model is used to calculate hadronic dissociation cross sections for one, two, and three nucleon removal for the first time for a 14.6A GeV 28Si beam fragmenting in aluminum, tin, and lead targets. These estimates are compared with recent semi-inclusive measurements. Significant differences between some calculated and measured semi-inclusive cross sections exist which cannot be resolved without measurements of the exclusive channel hadronic cross sections. Calculations for each exclusive reaction channel contributing to the semi-inclusive cross sections are presented and discussed.

NASA Program Radiation Health↗
NASA NTRS2001

Influence of Wake Models on Calculated Tiltrotor Aerodynamics

The tiltrotor aircraft configuration has the potential to revolutionize air transportation by providing an economical combination of vertical take-off and landing capability with efficient, high-speed cruise flight. To achieve this potential it is necessary to have validated analytical tools that will support future tiltrotor aircraft development. These analytical tools must calculate tiltrotor aeromechanical behavior, including performance, structural loads, vibration, and aeroelastic stability, with an accuracy established by correlation with measured tiltrotor data. The recent test of the Tilt Rotor Aeroacoustic Model (TRAM) with a single,l/4-scale V-22 rotor in the German-Dutch Wind Tunnel (DNW) provides an extensive set of aeroacoustic, performance, and structural loads data. This paper will examine the influence of wake models on calculated tiltrotor aerodynamics, comparing calculations of performance and airloads with TRAM DNW measurements. The calculations will be performed using the comprehensive analysis CAMRAD II.

Johnson, Wayne↗
NASA NTRS2020

Julia Language 1.1 Ephemeris Reader and Gravitational Modeling Program for Solar System Bodies

This paper analyzes the advancements to the Julia Language 1.1 Ephemeris and Physical constants Reader including the addition of gravitational modeling. Originally written in MATLAB, this Julia Language program is intended to be used in for trajectory design. Written in an open-source coding language, this ephemeris reader can output the state of planetary bodies including asteroids as well as other constants such as gravitational parameters. Two primary methods were chosen to calculate the gravitational potentials which include polyhedral modeling and spherical harmonics.

Gray, Brennan↗
NASA NTRS1991

Calculations of hadronic dissociation of Si-28 projectiles at 14.6A GeV by nucleon emission

An optical potential abrasion-ablation collision model is used to calculate hadronic dissociation cross sections for one, two, and three nucleon removal for the first time for a 14.6A GeV Si-28 beam fragmenting in aluminum, tin, and lead targets. These estimates are compared with recent semiinclusive measurements. Significant differences between some calculated and measured semiinclusive cross sections exist which cannot be resolved without measurements of the exclusive channel hadronic cross sections. Calculations for each exclusive reaction channel contributing to the semiinclusive cross sections are presented and discussed.

Townsend, Lawrence W.↗
NASA NTRS1992

Analysis of the effect of initial conditions on the initial development of a turbulent jet

The effect of the initial condition at the jet exit on the downstream evolution, particularly within the potential core length, were numerically investigated as well as with available experimental data. In order to select the most dependable computational model for the present numerical experiment, a comparative study has been performed with different turbulence models at k-epsilon level, and it was found that the k-epsilon-gammma model yields superior prediction accuracy over other conventional models. The calculated results show that the potential core length and the spreading rate the initial mixing layer are dependent on the initial length scale as well as the turbulent kinetic energy at the jet exit. Such effect of the initial length scale increases with higher initial turbulence level. An empirical parameter has been devised to collapse the calculated data of the potential core length and the spreading rate with various initial conditions onto a single curve.

Kim, Soong KI↗
DOE OSTI2026

Isospin symmetry holds beyond the proton drip line: First observation of excited states in 55Cu

Isospin symmetry, combined with shell-model description, has long been successful in reproducing nuclear structure and predicting mirror energy differences. However, these descriptions have been primarily limited to mirror nuclei with well-bound ground states. As one approaches the proton drip line, coupling to the continuum becomes important. Despite this, little is known about medium-mass nuclei at the drip line. Here we report the measurement of the excitation energies of several unbound states in a nucleus beyond the proton drip line, 55Cu, performed via γ-ray spectroscopy at the Radioactive Isotope Beam Factory (RIKEN). Several low-lying yrast states are observed to decay predominantly by γ-ray emission. In contrast, the state–predicted to be strongly populated in the one-proton knockout reaction–is notably absent, suggesting that it decays primarily via prompt proton emission. We show that even for such an unbound system, shell-model calculations based on a harmonic oscillator potential reproduce the observed mirror energy differences remarkably well in all the observed states. Based on this result, we propose that a general pattern might emerge where, in medium-mass systems at the proton drip line, the stronger Coulomb barrier together with the centrifugal barrier effectively confines the wave functions, so that the shell model is able to describe low-lying states, enabling accurate predictions of mirror energy differences between isobaric analogue states.

Pigliapoco, S [Dipartimento di Fisica e Astronomia↗
DOE OSTI2025

Systematic improvement of redox potential calculation of Fe(III)/Fe(II) complexes using a three-layer micro-solvation model

Electrochemical transformations of metal ions in aqueous media are challenging to model accurately due to the dynamic solvation structure surrounding ions at different charge states. Predictive modeling at the atomistic scale is essential for understanding these solvation architectures but is often computationally prohibitive. In this contribution, we present a simple, fast, and accurate three-layer micro-solvation model to evaluate the redox potential of metal ions in aqueous solutions. Our model, developed and validated for Fe 3+ /Fe 2+ redox potentials, combines the DFT-based geometry optimizations of the octahedral Fe complex with two layers of explicit water molecules to capture solute–solvent interactions and an implicit solvation model to account for bulk solvent effects. This approach yields accurate predictions for Fe 3+ /Fe 2+ redox potentials in water, achieving errors of 0.02 V with ωB97X-V, 0.01 V with ωB97X-D3, 0.04 V with ωB97M-V, and 0.02 V with B3LYP-D3 functionals. We further demonstrate the generality of our model by applying it to additional metal complexes, including the challenging Fe(CN) 6 3−/4− system, where our model successfully achieves close agreement with experimental values, with an error of 0.07 V and an average error of 0.21 V for all five systems. In summary, the presented simple solvation model has broad applicability and potential for enhancing computational efficiency in redox potential predictions across various chemical and industrial processes of metal ions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1985

Numerical solution of the full-potential equation for rotors and oblique wings using a new wake model

A three-dimensional, full-potential, quasi-steady code TFAR1 is proposed for calculating the transonic flow past a lifting helicopter rotor blade and oblique wing. The TFAR1 uses a two-dimensional nonlinear wake-model that allows a jump in velocity potential to propagate with the local fluid flow in the wake. Rotor calculations were made for a single blade at an advance ratio of 0.3, a rotational tip Mach number of 0.7, and at 0-degree incidence. A 1/7-scale model of the Cobra Operational Load Survey (OLS) rotor blade is calculated, and the pressure distributions are compared to the measurements for azimuth angles 0, 30, 60, 90, 120, and 150 degrees at the 95 percent spanwise station of the OLS blade. Furthermore, an oblique wing with Korn airfoil was calculated at the high transonic free-stream Mach number of 0.9791, zero incidence, and yaw angle of 40 degrees. The TFAR1, coupled with a helicopter performance code CAMRAD (Johnson, 1981), provides a full-potential code for calculating the entire flow field for a multiple-bladed rotor in transonic lifting forward flight.

Chang, I.-C.↗
DOE OSTI2021

Photovoltaic (PV) System Levelized Cost of Energy (LCOE) Evaluation with Grid Support Function Valuation and Service Lifetime Estimation

Photovoltaic (PV) systems play a critical role in renewable energy resource grid integration, and levelized cost of energy (LCOE) is commonly used to evaluate PV system feasibility in modern power grids. In this work, a revised PV system LCOE calculation model is derived to quantify the potential of LCOE reduction. Particularly, the grid support functions are valuated to offset the investment and operation costs of PV systems, which thereby reduces the LCOE. Meanwhile, PV system service lifetime is also estimated with the derived PV inverter reliability model, considering the critical components (i.e., semiconductor devices and capacitors). The case studies with field datasets are conducted to validate the effectiveness of the developed LCOE calculation model.

Zhao, Shijia↗
DOE OSTI2020

Solving complex eigenvalue problems on a quantum annealer with applications to quantum scattering resonances

Quantum computing is a new and rapidly evolving paradigm for solving chemistry problems. In previous work, we developed the Quantum Annealer Eigensolver (QAE) and applied it to the calculation of the vibrational spectrum of a molecule on the D-Wave quantum annealer. However, the original QAE methodology was applicable to real symmetric matrices only. For many physics and chemistry problems, the diagonalization of complex matrices is required. For example, the calculation of quantum scattering resonances can be formulated as a complex eigenvalue problem where the real part of the eigenvalue is the resonance energy and the imaginary part is proportional to the resonance width. In the present work, we generalize the QAE to treat complex matrices: first complex Hermitian matrices and then complex symmetric matrices. These generalizations are then used to compute a quantum scattering resonance state in a 1D model potential for O + O collisions. These calculations are performed using both a software (classical) annealer and hardware annealer (the D-Wave 2000Q). The results of the complex QAE are also benchmarked against a standard linear algebra library (LAPACK). Furthermore, this work presents the first numerical solution of a complex eigenvalue problem of any kind on a quantum annealer, and it is the first treatment of a quantum scattering resonance on any quantum device.

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

Time-dependent experimental identification of inter-ELM microtearing modes in the tokamak edge on DIII-D

In a series of discharges on the DIII-D tokamak, fast vertical plasma jogs are used to induce current perturbations in the steep gradient region of the H-mode edge. These current perturbations directly influence the edge q profile, decoupling the resonant location and instability drive of pedestal-localized microtearing modes (MTMs.) By exploiting this effect, we develop and apply a new experimental technique to track the dynamical frequency evolution of MTMs in the pedestal region, providing a compelling validation of the MTM model. The frequency of potential MTMs is calculated as the Doppler-shifted electron diamagnetic frequency at rational q=m/n surfaces, showing remarkable agreement with chirped frequency behavior of n=3, 4 and 5 modes detected with fast magnetics. Data is collected throughout multiple ELM cycles in order to build robust statistics describing the time-dependent frequency evolution of MTMs, which can be explained by examining the recovery of pedestal gradients after an ELM event. MTMs have a dominant transport contribution in the electron thermal channel, so the presented results indicate that reduced models of pedestal transport must be electromagnetic in nature and constructed with accurate calculations of MTM stability; inclusion of this physics is essential for accurate predictions of the electron temperature pedestal profile. Supporting measurements of mode saturation, propagation direction and transport fingerprints are made to support the dynamic frequency determination, unambiguously and experimentally identifying MTMs in the pedestal region of DIII-D.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS1984

Statistical mechanics of light elements at high pressure. VI - Liquid-state calculations with Thomas-Fermi-Dirac theory

A model free energy is developed for hydrogen-helium mixtures based on solid-state Thomas-Fermi-Dirac calculations at pressures relevant to the interiors of giant planets. Using a model potential similar to that for a two-component plasma, effective charges for the nuclei (which are in general smaller than the actual charges because of screening effects) are parameterized, being constrained by calculations at a number of densities, compositions, and lattice structures. These model potentials are then used to compute the equilibrium properties of H-He fluids using a charged hard-sphere model. The results find critical temperatures of about 0 K, 500 K, and 1500 K, for pressures of 10, 100, and 1000 Mbar, respectively. These phase separation temperatures are considerably lower (approximately 6,000-10,000 K) than those found from calculations using free electron perturbation theory, and suggest that H-He solutions should be stable against phase separation in the metallic zones of Jupiter and Saturn.

Macfarlane, J. J.↗
NASA NTRS2004

Advancing Solid Earth Science through Improved Atmosphere Modeling

We proposed to investigate and develop better models for the effect of the hydrostatic and water vapor components of the neutral atmosphere on delay for VLBI and GPS by using a Numerical Weather Model to better simulate realistic atmosphere conditions. By using a raytrace calculation through the model atmosphere at the times of actual VLBI observations, the potential improvement in geodetic results can be evaluated. Also, by calculating the actual variation of delays with elevation and azimuth, the errors in current mapping function models can be assessed. The VLBI data to be initially analyzed are the fifteen days of the CONT02 sessions of 2002 October which included eight stations. There are three segments to the research. 1) The PSU/NCAR fifth generation mesoscale numerical weather model (MM5) will be used to provide the state of the atmosphere with highest horizontal resolution of 3 km. 2) A three-dimensional raytrace program will be developed to determine the delays through the model atmosphere at the times and in the directions of the VLBI observations for each of the sites. 3) The VLBI data will be analyzed using both standard models for the atmosphere mapping functions and the mapping functions derived from the NWM raytracing.

Niell, A. E.↗
DOE OSTI2021

Excited-state potentials for modelling dense plasmas from first principles

The modelling of dense plasmas using finite-temperature density functional theory has proven very successful in determining transport properties and the equation of state of systems where quantum many-body effects and correlations play a key role in their structure. Here we show how excited-state projector augmented- wave potentials can be used to extend these calculations to explicitly model core-hole states, allowing for the calculation of the electronic structure of a range of integer charge configurations embedded in a dense plasma environment. Our excited-state potentials show good agreement with all-electron calculations at finite-temperatures, motivating their use as an efficient approach in modelling from first principles both the structure of strongly-coupled non-equilibrium plasmas and their interaction with intense X-rays.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2022

Nuclear states projected from a pair condensate

Atomic nuclei exhibit deformation, pairing correlations, and rotational symmetries. To meet these competing demands in a computationally tractable formalism, we revisit the use of general pair condensates with good particle number as a trial wave function for even-even nuclei. After minimizing the energy of the condensate, allowing for general triaxial deformations, we project out states with good angular momentum with a fast projection technique. To show applicability, we present example calculations from pair condensates in several model spaces and compare against angular-momentum projected Hartree-Fock and full configuration-interaction shell-model calculations. This approach successfully generates spherical, vibrational, and rotational spectra, demonstrating potential for modeling medium- to heavy-mass nuclei.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS1981

Some aspects of calculating flows about three-dimensional subsonic inlets

Based on the potential flow model, computations were carried out for various three-dimensional inlet models. Some of these calculated results are presented in the forms of surface static pressure, flow angularity, surface flow pattern, and inlet flow field. Comparisons with experimental data are also made.

Kao, H. C.↗