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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

Kinetics of mineral condensation in the solar nebula

A natural extension of the type of gas-mineral-melt condensation experiments is to study the gas-mineral-melt reaction process by controlling the reaction times of appropriate gas compositions with silicate materials. In a condensing and vaporizing gas-solid system, important processes that could influence the composition of and speciation in the gas phase are the kinetics of vaporization of components from silicate crystals and melts. The high vacuum attainable in the space station would provide an environment for studying these processes at gas pressures much lower than those obtainable in experimental devices operated at terrestrial conditions in which the gas phase and mineral or melt would be allowed to come to exchange equilibrium. Further experiments would be performed at variable gas flow rates to simulate disequilibrium vapor fractionation. In this type of experiment it is desirable to analyze directly the species in the gas phase in equilibrium with the condensed silicate material. This analytical method would provide a direct determination of the species present in the gas phase. Currently, the notion of gas speciation is based on calculations from thermodynamic data. The proposed experiments require similar furnace designs and use similar experimental starting compositions, pressures, and temperatures as those described by Mysen.

Grove, T. L.↗
NASA NTRS1988

Water activities in the Kerala Khondalite Belt

The author and colleagues presented their determinations of water activities in various granulite-facies rocks of the Kerala Khondalite Belt. Using mineral equilibria, thermodynamic data, and assumed geopressure-geotemperature conditions of 5.5 kbar and 750 C, they calculated uniformly low a(H2O) values of about 0.27 over a large geographic region. They suggested that these conditions were produced by the presence of abundant CO2-rich fluids, derived either from deeper levels or from metamorphic reactions involving graphite.

Chacko, Thomas↗
NASA NTRS1988

High speed inlet calculations with real gas effects

A 2-D steady-state Navier-Stokes solver has been upgraded to include the effects of frozen and equilibrium air chemistry for applications to high speed flight vehicles. To provide a computationally economical first order approximation to the high temperature physics, variable thermodynamic data is used for the chemically frozen mode to allow for a variation with temperature of the air specific heats and enthalpy. For calculations involving air in chemical equilibrium, a specially modified version of the NASA Lewis Chemical Equilibrium Code, CEC, is used to compute the chemical composition and resultant thermochemical properties. The upgraded solver is demonstrated by comparing results from calorically perfect (C sub p=constant), thermally perfect (frozen) and equilibrium air calculations for a variety of geometries, and flight Mach numbers.

Coirier, William J.↗
NASA NTRS1988

Solubility and equilibrium vapor pressures of HC1 dissolved in polar stratospheric cloud materials - Ice and the trihydrate of nitric acid

Measurements of the pressure-solubility behavior of HC1 in water ice and in the nitric acid trihydrate (NAT) crystal at 200 K are reported. It was found that HC1 is about 20 times more soluble in NAT than in ice for stratospheric conditions. A relation between HC1 pressure and substrate composition based on the Gibbs-Duhem equation is developed. This relation, along with other thermodynamic data, can be used to obtain the HC1 pressure-solubility behavior at different temperatures. Implications of these results for the south polar ozone hole are discussed.

Hanson, David↗
NASA NTRS1992

Development of the KIVA-2 CFD code for rocket propulsion applications

The KIVA-2 code, originally developed to solve computational fluid dynamics problems in internal combustion engines, has been developed to solve rocket propulsion type flows. The objective of the work was to develop a code such that both liquid and solid particle motion could be simulated for arbitrary geometry and high speed as well as low speed reacting flows. Modification to the original code include: incorporating independently specific supersonic and subsonic inflows and outflows; symmetric as well as periodic boundary conditions; and the capability to use generalized single or multi-specie thermodynamic data and transport coefficients allowing the user to specify arbitrary wall temperature/heat flux distributions. This code has been shown to successfully solve rocket propulsion flows as well as flows with entrained particles for several different rocket nozzles.

Shannon, Robert V., Jr.↗
NASA NTRS1992

Measurements of the fundamental thermodynamic parameters of Li/BCX and Li/SOCl2 cells

Two experimental techniques - equilibrium or reversible cell discharge and measurement of open circuit potential as a function of temperature - are used to determine the thermodynamic data needed to estimate the heat generation characteristics of Li/BCX and Li/SOCl2 cells. The results obtained showed that the reversible cell potential, the temperature dependence of the reversible cell potential, and the thermoneutral potential of the BCX cell were 3.74 V, -0.857 +/- 0.198 mV/K, and 3.994 +/- 0.0603 V, respectively. The respective values obtained for the Li/SOCl2 cell were 3.67 V, -0.776 +/- 0.255 mV/K, and 3.893 +/- 0.0776 V. The difference between the thermoneutral potential of Li/BCX and Li/SCl2 cells is attributable to the difference in their electroactive components.

Kalu, E. E.↗
NASA NTRS1992

Lunar mining of oxygen using fluorine

An important aspect of lunar mining will be the extraction of volatiles, particularly oxygen, from lunar rocks. Thermodynamic data show that oxygen could readily be recovered by fluorination of abundant lunar anorthite, CaAl2Si2O8. Fluorine is the most reactive element, and the only reagent able to extract 100 percent of the oxygen from any mineral, yet it can safely be stored or reacted in nickel or iron containers. The general fluorination reaction, mineral + 2F2 = mixed fluorides = O2, has been used for more than 30 years at a laboratory scale by stable-isotope geochemists. For anorthite, metallic Al and Si may be recovered from the mixed fluorides by Na-reduction, and CaO via exchange with Na2O; the resulting NaF may be recycled into F2 and Na by electrolysis, using lanthanide-doped CaF2 as the inert anode.

Burt, Donald M.↗
NASA NTRS1993

Vapor pressures of solid hydrates of nitric acid - Implications for polar stratospheric clouds

Thermodynamic data are presented for hydrates of nitric acid: HNO3.H2O, HNO3.2H2O, HNO3.3H2O, and a higher hydrate. Laboratory data indicate that nucleation and persistence of metastable HNO3.2H2O may be favored in polar stratospheric clouds over the slightly more stable HNO3.3H2O. Atmospheric observations indicate that some polar stratospheric clouds may be composed of HNO3.2H2O and HNO3.3H2O. Vapor transfer from HNO3.2H2O to HNO3.3H2O could be a key step in the sedimentation of HNO3, which plays an important role in the depletion of polar ozone.

Worsnop, Douglas R.↗
NASA NTRS1993

Moisture and heat budgets of a cirrus cloud from aircraft measurements during FIRE

This study is based on the NCAR King Air aircraft and radiosonde observations on 31 October 1986 during the FIRE in Wisconsin over Oshkosh. Aircraft step-up and spiral descent flights are used to obtain kinematic and thermodynamic data. In the step-up maneuver, six different penetrations were made between 1528 and 1616 UTC. Each penetration was about 30 km long separated in the vertical by about 300 m. The time difference between the two spiral soundings was about 43 min. The aircraft descended at a rate of 1.5 m/s during these spiral soundings. Kinematic, cloud physical, and radiometric observations from various instruments are used to estimate the different terms in the moisture- and heat-budget equations. The results show that the advection terms, estimated using the mean longitudinal wind and vertical velocities, and radiative fluxes are important in forming budgets for the cirrus layers. Ice-crystal growth is significant in the upper layers. The maintenance of cirrus can be attributed to relatively warm and moist air advection, radiative cooling at upper levels, and moisture advection in the vertical. Turbulent heat and moisture fluxes are found to be significant in the low levels of cirrus.

Gultepe, Ismail↗
NASA NTRS1958

Composition and Thermodynamic Properties of Air in Chemical Equilibrium

Charts have been prepared relating the thermodynamic properties of air in chemical equilibrium for temperatures to 15,000 degrees k and for pressures 10(-5) to 10 (plus 4) atmospheres. Also included are charts showing the composition of air, the isentropic exponent, and the speed of sound. These charts are based on thermodynamic data calculated by the National Bureau of Standards.

Moeckel, W E↗
NASA NTRS1951

Investigation of the Liquid Fluorine-liquid Diborane Propellant Combination in a 100-pound-thrust Rocket Engine

The experimental performance of liquid fluorine and liquid diborane was investigated in a 100-pound-thrust engine at a combustion pressure of 300 pounds per square inch absolute. Methods of handling and transporting liquid fluorine were developed. It was extremely difficult to obtain satisfactory operation because of the high flame speed and high combustion chamber temperatures. The maximum performance obtained was 280 pound seconds per pound, 88 percent of the theoretical maximum. The theoretical performance was recalculated with revised thermodynamic data, indicating a maximum specific impulse of 311 pound seconds per pound as compared with the previously reported value of 323.

COMBUSTION - ROCKET ENGINES↗
NASA NTRS1993

Experimental partitioning of Zr, Ti, and Nb between silicate liquid and a complex noble metal alloy and the partitioning of Ti between perovskite and platinum metal

El Goresy et al.'s observation of Nb, Zr, and Ta in refractory platinum metal nuggets (RPMN's) from Ca-Al-rich inclusions (CAI's) in the Allende meteorite led them to propose that these lithophile elements alloyed in the metallic state with noble metals in the early solar nebula. However, Grossman pointed out that the thermodynamic stability of Zr in the oxide phase is vastly greater than metallic Zr at estimated solar nebula conditions. Jones and Burnett suggested this discrepancy may be explained by the very non-ideal behavior of some lithophile transition elements in noble metal solutions and/or intermetallic compounds. Subsequently, Fegley and Kornacki used thermodynamic data taken from the literature to predict the stability of several of these intermetallic compounds at estimated solar nebula conditions. Palme and Schmitt and Treiman et al. conducted experiments to quantify the partitioning behavior of certain lithophile elements between silicate liquid and Pt-metal. Although their results were somewhat variable, they did suggest that Zr partition coefficients were too small to explain the observed 'percent' levels in some RPMN's. Palme and Schmitt also observed large partition coefficients for Nb and Ta. No intermetallic phases were identified. Following the work of Treiman et al., Jurewicz and Jones performed experiments to examine Zr, Nb, and Ti partitioning near solar nebula conditions. Their results showed that Zr, Nb, and Ti all have an affinity for the platinum metal, with Nb and Ti having a very strong preference for the metal. The intermetallic phases (Zr,Fe)Pt3, (Nb,Fe)Pt3, and (Ti,Fe)Pt3 were identified. Curiously, although both experiments and calculations indicate that Ti should partition strongly into Pt-metal (possibly as TiPt3), no Ti has ever been observed in any RPMN's. Fegley and Kornacki also noticed this discrepancy and hypothesized that the Ti was stabilized in perovskite which is a common phase in Allende CAI's.

Jurewicz, Stephen R.↗
NASA NTRS1993

Earth's partial pressure of CO2 over the past 120 Ma; evidence from Ce anomalies in the deep (greater than 600 m) Pacific Ocean, 1

It was found that Ce serves as a chemical tracer of paleo-oceanic redox conditions. It was shown that the unoxidized and soluble Ce(3+) in modern seawater exhibits a negative anomaly relative to the other soluble REE(3+). An expression of soluble Ce(3+) in seawater that was approximately 1900X greater than the average observed in Ce in 600-5000 m Pacific seawater was derived. Since Ce(CO3)(+) and Ce(CO3)2(-) complexes greatly exceed the Ce(PO4) complexes in seawater, the formulations of using carbonate complexes were followed and it was found that the calculated Ce and observed concentrations in the deep 600-5000 m Pacific Ocean agree within the uncertainties of the thermodynamic data. As expected, the calculated Ce concentrations are a strong function of pH and found to be lesser functions of CO3(2-) activities.

Liu, Y.-G↗
NASA NTRS1994

Thermochemistry of dense hydrous magnesium silicates

Recent experimental investigations under mantle conditions have identified a suite of dense hydrous magnesium silicate (DHMS) phases that could be conduits to transport water to at least the 660 km discontinuity via mature, relatively cold, subducting slabs. Water released from successive dehydration of these phases during subduction could be responsible for deep focus earthquakes, mantle metasomatism and a host of other physico-chemical processes central to our understanding of the earth's deep interior. In order to construct a thermodynamic data base that can delineate and predict the stability ranges for DHMS phases, reliable thermochemical and thermophysical data are required. One of the major obstacles in calorimetric studies of phases synthesized under high pressure conditions has been limitation due to the small (less than 5 mg) sample mass. Our refinement of calorimeter techniques now allow precise determination of enthalpies of solution of less than 5 mg samples of hydrous magnesium silicates. For example, high temperature solution calorimetry of natural talc (Mg(0.99) Fe(0.01)Si4O10(OH)2), periclase (MgO) and quartz (SiO2) yield enthalpies of drop solution at 1044 K to be 592.2 (2.2), 52.01 (0.12) and 45.76 (0.4) kJ/mol respectively. The corresponding enthalpy of formation from oxides at 298 K for talc is minus 5908.2 kJ/mol agreeing within 0.1 percent to literature values.

Bose, Kunal↗
NASA NTRS1996

Volatile Hydroxide Species of Common Protective Oxides and their Role in High Temperature Corrosion

Thermodynamic data for volatile hydroxides and oxyhydroxides formed from the reaction of water vapor with Cr2O3, SiO2, A12O3, Y2O3,. and ZrO2 were assembled. The volatile species formed at temperatures between 800 and 2200K in model combustion environments containing 10% water vapor and 10% oxygen at 1 and 10 bar total pressure were calculated using free energy minimization techniques. Assuming an acceptable maximum vapor pressure limit for volatile species of 10 bar, an upper use temperature for these oxides was determined at 1 and 10 bar total pressure. The dependence of these volatile species on both water vapor and oxygen pressure was determined.

Opila, Elizabeth J.↗
NASA NTRS2000

Interpreting Assemblages with Titanite (Sphene): It Does not have to be Greek to You.

Assemblages with titanite, pyroxene(s), olivine, ilmenite, magnetite, and quartz can be used to constrain the intensive and compositional variables that operate during crystallization. Such assemblages are relatively rare in metamorphic rocks, but they are more common in igneous rocks and more frequently reported in plutonic than volcanic rocks. We used the program QUILF, enhanced with thermodynamic data for titanite, to compute stable reactions among titanite (CaTiOSiO4), Fe-Mg-Ti ilmenite and magnetite (hereafter ilmenite and magnetite), Ca-Mg-Fe pyroxenes and olivine, and quartz, and to evaluate some of the factors that control titanite stability. Calculations at 1, 3, and 6 Kbar and 650, 850, 1100 0 C, in the system CaO - MgO - FeO Fe2O3 - TiO2 - SiO2, suggest that the reactions: Augitc + Ilmenite = Titanite + Magnetite + Quartz and Augite + Ilmenite + Quartz = Titanite + Orthopyroxene, impose well defined fugacity of O2, alpha(sub SiO2), , and compositional restrictions to the assemblages: (1) Titanite + Magnetite + Quartz, (2) Titanite + Orthopyroxene, (3) Augite + Ilmenite, and consequently titanite stability. From our calculations in this system we can draw the following general conclusions: (1) The assemblage Titanite + Magnetite + Quartz is always a good indicator of relatively high fugacity of O2, and it is likely more common in relatively iron-rich bulk compositions and for decreasing temperature and pressure conditions. (2) At high temperatures (>= 650 C) titanite is not stable in quartz-saturated rocks that contain the assemblage Orthopyroxene + Augite + Ilmenite + Magnetite. (3) In quartz-saturated rocks the coexistence of titanite and magnetite with either orthopyroxene or olivine requires a confluence of conditions relating bulk composition, fugacity of O2, and slow cooling. Thus, such assemblages must be rare. (4) Regardless of T and fugacity of O2 conditions, and bulk-composition, titanite is not stable in quartz-absent rocks that contain Olivine + Orthopyroxene + Augite + Ilmenite + Magnetite. Decreasing temperature and pressure conditions appear to favor titanite crystallization, thus, it is not unsurprising that titanite is frequently observed in slowly cooled rocks, albeit, in association with amphibole. We argue that the titanite + amphibole association is likely favored by high water activity, regardless of oxygen fugacity. Because water activity increases during crystallization of a pluton, the association titanite + amphibole, and consequently titanite, is likely to be more common in plutonic rocks than in volcanic rocks.

Xirouchakis, Dimitrios M.↗
NASA NTRS2001

The Biogeochemistry of Sulfur in Hydrothermal Systems

The incorporation of sulfur into many biomolecules likely dates back to the development of the earliest metabolic strategies. Sulfur is common in enzymes and co-enzymes and is an indispensable structural component in many peptides and proteins. Early metabolism may have been heavily influenced by the abundance of sulfide minerals in hydrothermal systems. The incorporation of sulfur into many biomolecules likely dates back to the development of the earliest metabolic strategies. Sulfur is common in enzymes and co-enzymes and is an indispensable structural component in many peptides and proteins. Early metabolism may have been heavily influenced by the abundance of sulfide minerals in hydrothermal systems. Understanding how sulfur became prevalent in biochemical processes and many biomolecules requires knowledge of the reaction properties of sulfur-bearing compounds. We have previously estimated thermodynamic data for thiols, the simplest organic sulfur compounds, at elevated temperatures and pressures. If life began in hydrothermal environments, it is especially important to understand reactions at elevated temperatures among sulfur-bearing compounds and other organic molecules essential for the origin and persistence of life. Here we examine reactions that may have formed amino acids with thiols as reaction intermediates in hypothetical early Earth hydrothermal environments. (There are two amino acids, cysteine and methionine, that contain sulfur.) Our calculations suggest that significant amounts of some amino acids were produced in early Earth hydrothermal fluids, given reasonable concentrations H2, NH3, H2S and CO. For example, preliminary results indicate that glycine activities as high as 1 mmol can be reached in these systems at 100 C. Alanine formation from propanethiol is also a favorable reaction. On the other hand, the calculated equilibrium log activities of cysteine and serine from propanethiol are -21 and -19, respectively, at 100 C. These results indicate that while amino acid formation with thiols as intermediates is favored in some cases, other mechanisms may have been necessary to produce significant amounts of other amino acids. Coupled with our previous results for thiols, these studies imply that sulfur may have been easily incorporated into the organic geochemistry of early Earth hydrothermal systems, leading to its widespread use in biomolecules. Formation of more complex biomolecules in hydrothermal systems may have required sulfur-bearing organic compounds as reaction intermediates.

Schulte, Mitchell↗
NASA NTRS2002

Convection and Easterly Waves Observed in the Eastern Pacific ITCZ During EPIC2001

During the last three weeks of September 2001, the East Pacific Investigation of Climate Processes in the Coupled Ocean-Atmosphere System (EPIC2001) intensive field campaign focused on studies of deep convection in the ITCZ-cold tongue complex over the Mexican warm-pool region (10 deg. N 95 deg. W) of the eastern Pacific Ocean. Major observational platforms deployed during this phase of EPIC2001 included two ships, the NOAA R/V Ronald H. Brown and the NSF R/V Horizon, and two research aircraft including a NOAA P-3 and the NCAR C-130. This study utilizes new C-band Doppler radar and sounding observations collected aboard the R/V Ronald Brown to describe the 4-D structure of ITCZ convection as a function of the environmental forcing and phase of 3-5 day easterly wave passages. Three distinct easterly wave passages occurred during EPIC2001. Each wave originated in the eastern Atlantic Ocean and after moving over Central America and into the eastern Pacific, were easily identified in time-height profiles of wind and thermodynamic data collected at the position of the R/V Brown. In all cases, the wave trough axes (as defined by changes in the meridional and zonal wind direction and changes in pressure altitude) exhibited relatively weak shear at low to mid-levels and tilted westward with height. The humidity profile in each wave did not exhibit as great a tilt in the vertical as the trough axes. Consistent with previous studies of westward tilting waves over the western Pacific Ocean, peaks in radar diagnosed rainfall tended to lead the passage of the surface wave trough by 0-2 days.

Petersen, Walter A.↗