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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 55 records · Page 3
All sourcesNASA NTRSDOE OSTI
NASA NTRS1991

Measurement of cavity perturbation to determine the microwave absorption of a sphere in a single mode resonator

Experiments have been conducted on materials in a single mode microwave resonator to test predictions of a new theory of microwave absorption by a lossy dielectric sphere. An analysis of cavity perturbation for verifying the new absorption model revealed a limitation of a standard form of cavity perturbation theory and led to a modification which generalized its application. The cavity perturbations of a nylon sphere were used to calculate the complex permittivity using the standard perturbation theory and the modified form. These permittivity values were compared to that determined from cavity perturbation using a thin nylon rod where the standard and modified forms agree. The results show that the modification is necessary to correctly apply perturbation theory to spherical samples. A second experiment confirmed the theoretical prediction that under certain sample conditions the power absorbed by a sphere in a resonant cavity can be maximum at a location in the cavity where the empty cavity electric field intensity is a minimum.

Watkins, J. L.↗
NASA NTRS2021

OSIRIS-REx Orbit Trim Strategy

One of the more challenging aspects of the trajectory design for the OSIRIS-REx (Origins, Spectral Interpretation, Resource Identification, and Security-Regolith Explorer) mission at asteroid Bennu was maneuvering while in orbit. The orbital dynamics were highly perturbed by various sources, most notably solar radiation pressure, which degraded accuracy of long term predictions of the spacecraft’s location in orbit. Generally, the Navigation team had to solve three separate issues: correcting a perturbed orbit, changing to a different orbit, or phasing the or bitto place the spacecraft at a specific location at a specific time. The team composed a common framework using up to two maneuvers that could solve all of these problems using an identical schedule that allowed for consistent planning long before the final trajectory could be designed. This orbit trim strategy was successfully used for the first time in the Orbital B phase of the mission to maximize the duration of usable observing geometry in a time-variable orbit with strict operational limits. It was used an additional 3 times throughout the mission to adjust and/or change the orbit, most notably altering the orbit in the weeks prior to the successful Touch-And-Go (TAG)sample collection attempt. This same strategy was used to phase the orbit a total 10 times in preparation for each of the science sorties over potential sample sites, the TAG Rehearsals, and TAG. The trim strategy was demonstrated to be robust and performed exceptionally well in all aspects, which proved critical to a successful sample collection.

Daniel R. Wibben↗
NASA NTRS1987

Polar observation propulsion requirements

Orbit perturbations and their effect on polar earth-orbiting space-surveillance spacecraft propulsion requirements for hydrazine, nitrogen tetroxide/monomethyl hydrazine, resistojet, and arcjet propulsion systems are investigated. Estimates of the Delta V and propellant mass required to correct for perturbations for both low-altitude and Molniya spacecraft orbits are presented, and 400-36,000 km orbit altitudes, and 57-90 deg orbit inclinations, are considered. The dominant factors in perturbations to the orbit of low-altitude earth orbiters, resulting from the earth's nonsphericity, are the second zonal harmonic describing the earth's oblateness, and the perturbations due to the earth's north-south mass asymmetry.

Palaszewski, Bryan↗
DOE OSTI2024

An Attractive Way to Correct for Missing Singles Excitations in Unitary Coupled Cluster Doubles Theory

Coupled cluster methods based exclusively on double excitations are comparatively “cheap” and interesting model chemistries, as they are typically able to capture the bulk of the dynamic electron correlation effects. The trade-off in such approximations is that the effect of neglected excitations, particularly single excitations, can be considerable. Using standard and electron-pair-restricted T 2 operators to define two flavors of unitary coupled cluster doubles (UCCD) methods, we investigate the extent to which missing single excitations can be recovered from low-order corrections in many-body perturbation theory (MBPT) within the unitary coupled cluster (UCC) formalism. Here, our analysis includes the derivations of finite-order UCC energy functionals, which are used as a basis to define perturbative estimates of missed single excitations. This leads to the novel UCCD[4S] and UCCD[6S] methods, which consider energy corrections for missing single excitations through fourth- and sixth-order in MBPT, respectively. We also apply the same methodology to the electron-pair-restricted ansatz, but the improvements are only marginal. Our findings show that augmenting UCCD with these post hoc perturbative corrections can lead to UCCSD-quality results.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Excited state electronic structure of dimethyl disulfide involved in photodissociation at ∼200 nm

Dimethyl disulfide (DMDS), one of the smallest organic molecules with an S–S bond, serves as a model system for understanding photofragmentation in polypeptides and proteins. Prior studies of DMDS photodissociation excited at ∼266 nm and ∼248 nm have elucidated the mechanisms of S–S and C–S bond cleavage, which involve the lowest excited electronic states S 1 and S 2 . Far less is known about the dissociation mechanisms and electronic structure of relevant excited states of DMDS excited at ∼200 nm. Herein we present calculations of the electronic structure and properties of electronic states S 1 –S 6 accessed when DMDS is excited at ∼200 nm. Our analysis includes a comparison of theoretical and experimental UV spectra, as well as theoretically predicted one-dimensional cuts through the singlet and triplet potential energy surfaces along the S–S and C–S bond dissociation coordinates. Finally, we present calculations of spin–orbit coupling constants at the Franck–Condon geometry to assess the likelihood of ultrafast intersystem crossing. We show that choosing an accurate yet computationally efficient electronic structure method for calculating the S 0 –S 6 potential energy surfaces along relevant dissociation coordinates is challenging due to excited states with doubly excited character and/or mixed Rydberg-valence character. Our findings demonstrate that the extended multi-state complete active space second-order perturbation theory (XMS-CASPT2) balances this computational efficiency and accuracy, as it captures both the Rydberg character of states in the Franck–Condon region and multiconfigurational character toward the bond-dissociation limits. In conclusion, we compare the performance of XMS-CASPT2 to a new variant of equation of motion coupled cluster theory with single, double, and perturbative triple corrections, EOM-CCSD(T)(a)*, finding that EOM-CCSD(T)(a)* significantly improves the treatment of doubly excited states compared to EOM-CCSD, but struggles to quantitatively capture asymptotic energies along bond dissociation coordinates for these states.

Rishi, Varun↗
NASA NTRS1974

In-situ measurements of lunar heat flow

During the Apollo program two successful heat flow measurements were made in situ on the lunar surface. At the Apollo 15 site a value of 0.0000031 watts/sqcm was measured and at the Apollo 17 site a value of 0.0000022 watts/sqcm was determined. Both measurements have uncertainty limits of + or - 20% and have been corrected for perturbing topographic effects. The apparent difference between the observations may correlate with observed variations in the surface abundance of thorium. Comparison with earlier determinations of heat flow, using the microwave emission spectrum from the moon, gives support to the high gradients and heat flows observed in situ.

Langseth, M. G.↗
NASA NTRS1977

Information processing requirements for on-board monitoring of automatic landing

A systematic procedure is presented for determining the information processing requirements for on-board monitoring of automatic landing systems. The monitoring system detects landing anomalies through use of appropriate statistical tests. The time-to-correct aircraft perturbations is determined from covariance analyses using a sequence of suitable aircraft/autoland/pilot models. The covariance results are used to establish landing safety and a fault recovery operating envelope via an event outcome tree. This procedure is demonstrated with examples using the NASA Terminal Configured Vehicle (B-737 aircraft). The procedure can also be used to define decision height, assess monitoring implementation requirements, and evaluate alternate autoland configurations.

Sorensen, J. A.↗
NASA NTRS1977

In-situ measurements of lunar heat flow

During the Apollo program two successful heat flow measurements were made in situ on the lunar surface. At the Apollo 15 site a value of .0000031 W/sq cm was measured, and at the Apollo 17 site a value of .0000022 W/sq cm was determined. Both measurements have uncertainty limits of + or - 20 percent and have been corrected for perturbing topographic effects. The apparent difference between the observations may correlate with observed variations in the surface abundance of thorium. Comparison with earlier determinations of heat flow, using the microwave emission spectrum from the moon, gives support to the high gradients and heat flows observed in situ.

Langseth, M. B.↗
NASA NTRS1977

Navigation of the 1982 Jupiter Orbiter Probe mission

A new NASA interplanetary flight project, called Jupiter Orbiter Probe (JOP), has been recently approved by Congress. JOP involves a dual mission intended to explore the planet Jupiter and its environment with an atmospheric probe and a planetary orbiter spacecraft. The probe and orbiter vehicles are to be launched in tandem as a single spacecraft during the time from December 1981 to January 1982. The spacecraft will arrive at Jupiter at the earliest on November 14, 1984. Navigating the JOP spacecraft will be a critical task for the JOP mission. Attention is given to aspects of probe and orbiter delivery, Jupiter orbit insertion and perijove raise, the Satellite Tour, navigation development and the navigation system, the probe delivery, example orbits, velocity perturbation and correction, orbit determination characteristics, orbit determination and control profile, and the correction velocity requirements.

Rourke, K. H.↗
NASA NTRS1996

Passive Microwave Remote Sensing of Soil Moisture

Microwave remote sensing provides a unique capability for direct observation of soil moisture. Remote measurements from space afford the possibility of obtaining frequent, global sampling of soil moisture over a large fraction of the Earth's land surface. Microwave measurements have the benefit of being largely unaffected by cloud cover and variable surface solar illumination, but accurate soil moisture estimates are limited to regions that have either bare soil or low to moderate amounts of vegetation cover. A particular advantage of passive microwave sensors is that in the absence of significant vegetation cover soil moisture is the dominant effect on the received signal. The spatial resolutions of passive Microwave soil moisture sensors currently considered for space operation are in the range 10-20 km. The most useful frequency range for soil moisture sensing is 1-5 GHz. System design considerations include optimum choice of frequencies, polarizations, and scanning configurations, based on trade-offs between requirements for high vegetation penetration capability, freedom from electromagnetic interference, manageable antenna size and complexity, and the requirement that a sufficient number of information channels be available to correct for perturbing geophysical effects. This paper outlines the basic principles of the passive microwave technique for soil moisture sensing, and reviews briefly the status of current retrieval methods. Particularly promising are methods for optimally assimilating passive microwave data into hydrologic models. Further studies are needed to investigate the effects on microwave observations of within-footprint spatial heterogeneity of vegetation cover and subsurface soil characteristics, and to assess the limitations imposed by heterogeneity on the retrievability of large-scale soil moisture information from remote observations.

Njoku, Eni G.↗
NASA NTRS2007

Asymptotic Energies and QED Shifts for Rydberg States of Helium

This paper reviews progress that has been made in obtaining essentially exact solutions to the nonrelativistic three-body problem for helium by a combination of variational and asymptotic expansion methods. The calculation of relativistic and quantum electrodynamic corrections by perturbation theory is discussed, and in particular, methods for the accurate calculation of the Bethe logarithm part of the electron self energy are presented. As an example, the results are applied to the calculation of isotope shifts for the short-lived 'halo' nucleus He-6 relative to He-4 in order to determine the nuclear charge radius of He-6 from high precision spectroscopic measurements carried out at the Argonne National Laboratory. The results demonstrate that the high precision that is now available from atomic theory is creating new opportunities to create novel measurement tools, and helium, along with hydrogen, can be regarded as a fundamental atomic system whose spectrum is well understood for all practical purposes.

Drake, G.W.F.↗
NASA NTRS2011

Initiating Molecular Growth in the Interstellar Medium via Dimeric Complexes of Observed Ions and Molecules

A feasible initiation step for particle growth in the interstellar medium (ISM) is simulated by means of ab quantum chemistry methods. The systems studied are dimer ions formed by pairing nitrogen containing small molecules known to exist in the ISM with ions of unsaturated hydrocarbons or vice versa. Complexation energies, structures of ensuing complexes and electronic excitation spectra of the encounter complexes are estimated using various quantum chemistry methods. Moller-Plesset perturbation theory (MP2, Z-averaged perturbation theory (ZAP2), coupled cluster singles and doubles with perturbative triples corrections (CCSD(T)), and density functional theory (DFT) methods (B3LYP) were employed along with the correlation consistent cc-pVTZ and aug-cc-pVTZ basis sets. Two types of complexes are predicted. One type of complex has electrostatic binding with moderate (7-20 kcal per mol) binding energies, that are nonetheless significantly stronger than typical van der Waals interactions between molecules of this size. The other type of complex develops strong covalent bonds between the fragments. Cyclic isomers of the nitrogen containing complexes are produced very easily by ion-molecule reactions. Some of these complexes show intense ultraviolet visible spectra for electronic transitions with large oscillator strengths at the B3LYP, omegaB97, and equations of motion coupled cluster (EOM-CCSD) levels. The open shell nitrogen containing carbonaceous complexes especially exhibit a large oscillator strength electronic transition in the visible region of the electromagnetic spectrum.

Bera, Partha P.↗
NASA NTRS1999

Time-of-Arrival Lightning Location Retrieval Using an Oblate Spheroidal Earth Model

The problem of retrieving lightning ground strike location on an oblate spheroidal Earth using a network of 4 or more time-of-arrival sensors is considered. A recently developed analytic method for obtaining such retrievals on a spherical Earth surface is perturbed resulting in an iterative procedure to get correction terms. The perturbation procedure consists of applying a vector Newton's method to eqs. relating the distances from the lightning location to each sensor along a geodesic and the times of arrival of the wave produced by the lightning source at each sensor.

Solakiewicz, Richard↗
NASA NTRS2004

Kinematid Parameters of Corrective Postural Responses Differ between Upper and Lower Body Perturbations

Balance control is disrupted following prolonged microgravity exposure, and to better understand this, both upper and lower body perturbations have been used to study postural control in space flight crewmembers. However, differences between several postural response indicators observed using the two techniques suggest that different sensory systems may be involved in organizing responses to these different perturbation approaches. The present study sought to compare differences in parameters of corrective postural responses between upper body perturbations (pushes to the chest) and forward translations of the support surface. Nine subjects participated in this study. Forward translations were performed using a NeuroCom EquiTest(TM) CDP system, which was synchronized with a Northern Digital OptoTrak motion tracking system (3 subjects). Chest pushes were applied using a hand-held force transducer device and were performed using a stabilometric system (6 subjects). Analysis of EMG has shown that: i) the earliest response of the leg muscles was registered significantly later during forward translation of the support surface than during chest pushes, and ii) there was a tendency for the different order of leg muscles activation during the translation tests. Analysis of the kinematic data showed a significant difference in the subject's body segments inclinations during corrective postural responses to upper and lower body perturbations. It appears that upper body perturbations likely engage the vestibular system more rapidly, while lower body perturbations likely engage somatosensory systems more rapidly. These differences must be taken into account when choosing the type of perturbation for testing postural function.

Sayenko, G.↗