An approximate variational calculation of properties of the is sigma and 2p sigma states of h2 plus
Hydrogen molecule ion energy calculations at various internuclear separations
MOLECULE↗
SEARCH · Search NASA
Results for “hydrogen molecule”
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.
Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.
Thermodynamic properties and theoretical rocket performance of hydrogen to 100,000 K and 1.01325 x 10 to the 8th power N/sq m
The composition and thermodynamic properties were calculated for 100 to 110,000 K and 1.01325 x 10 to the 2nd power to 1.01325 x 10 to the 8th power N/sq m for chemical equilibrium in the Debye-Huckel and ideal-gas approximations. Quantities obtained were the concentrations of hydrogen atoms, protons, free electrons, hydrogen molecules, negative hydrogen ions, hydrogen diatomic molecular ions, and hydrogen triatomic molecular ions, and the enthalpy, entropy, average molecular weight, specific heat at constant pressure, density, and isentropic exponent. Electronically excited states of H and H2 were included. Choked, isentropic, one-dimensional nozzle flow with shifting chemical equilibrium was calculated to the Debye-Huckel and ideal-gas approximations for stagnation temperatures from 2500 to 100,000 K. The mass flow per unit throat area and the sonic flow factor were obtained. The pressure ratio, temperature, velocity, and ideal and vacuum specific impulses at the throat and for pressure ratios as low as 0.000001 downstream were found. For high temperatures at pressures approaching 1.01325 x 10 to the 8th power N/sq m, the ideal-gas approximation was found to be inadequate for calculations of composition, precise thermodynamic properties, and precise nozzle flow. The greatest discrepancy in nozzle flow occurred in the exit temperature, which was as much as 21 percent higher when the Debye-Huckel approximation was used.
Patch, R. W.↗
Effects of Multiscale Phase-Mixing and Interior Conductance in the Lunar-like Pickup Ion Plasma Wake. First Results from 3-D Hybrid Kinetic Modeling
The study of multiscale pickup ion phase-mixing in the lunar plasma wake with a hybrid model is the main subject of our investigation in this paper. Photoionization and charge exchange of protons with the lunar exosphere are the ionization processes included in our model. The computational model includes the self-consistent dynamics of the light (hydrogen ions or hydrogen molecule ion or helium ion), and heavy (sodium ion ) pickup ions. The electrons are considered as a fluid. The lunar interior is considered as a weakly conducting body. In this paper we considered for the first time the cumulative effect of heavy neutrals in the lunar exosphere (e.g., Aluminum, Argon), an effect which was simulated with one species of sodium ion but with a tenfold increase in total production rates. We find that various species produce various types of plasma tail in the lunar plasma wake. Specifically, sodium ion and helium ion pickup ions form a cycloid-like tail, whereas the hydrogen ion or hydrogen molecule ion pickup ions form a tail with a high density core and saw-like periodic structures in the flank region. The length of these structures varies from 1:5 R(sub M) to 3:3 R(sub M) depending on the value of gyro radius for hydrogen ion or hydrogen molecule ion pickup ions. The light pickup ions produce more symmetrical jump in the density and magnetic field at the Mach cone which is mainly controlled by the conductivity of the interior, an effect previously unappreciated. Although other pickup ion species had little effect on the nature of the interaction of the Moon with the solar wind, the global structure of the lunar tail in these simulations appeared quite different when the hydrogen molecule ion production rate was high.
Lipatov, A.S.↗
Mean excitation energy for molecules of hydrogen and carbon
The Gordon-Kim electron gas model of molecular bonding is used to calculate correction factors for the Bragg rule for molecules of hydrogen and carbon. General rules for molecular mean excitation energies are obtained that agree to about 4% with experimental values.
Wilson, J. W.↗
The interstellar H super plus sub 2 molecule.
Positively charged diatomic hydrogen molecules interstellar extinction and photodissociation cross section in terms of formation mechanisms
Stecher, T. P.↗
Interstellar molecules and dense clouds.
Current knowledge of the interstellar medium is discussed on the basis of recent published studies. The subjects considered include optical identification of interstellar molecules, radio molecular lines, interstellar clouds, isotopic abundances, formation and disappearance of interstellar molecules, and interstellar probing techniques. Diagrams are plotted for the distribution of galactic sources exhibiting molecular lines, for hydrogen molecule, hydrogen atom and electron abundances due to ionization, for the densities, velocities and temperature of NH3 in the direction of Sagitarius B2, for the lower rotational energy levels of H2CO, and for temporal spectral variations in masing H2O clouds of the radio source W49. Future applications of the maser and of molecular microscopy in this field are visualized.
Rank, D. M.↗
Lyman-alpha radiation from electron collisions with simple hydrogen containing molecules.
Lyman alpha radiation from electron collisions with simple H-containing molecules, finding dissociative excitation cross section role
Mcgowan, J. W.↗
Mechanism and kinetics of excited-state relaxation in internally hydrogen-bonded molecules - 2-/2'-hydroxy-5'-methylphenyl/-benzotriazole in solution
Explore the source record for details and available documents.
Huston, A. L.↗
An application of a statistical model for the calculation of the logarithmic mean excitation energy of molecules Molecular hydrogen
A statistical model, the local plasma approximation, is considered for the calculation of the logarithmic mean excitation energy for stopping power of chemically bound particles by taking into consideration chemical bonding. This statistical model is applied to molecular hydrogen and leads to results that suggest a value for the logarithmic mean excitation energy of molecular hydrogen that is larger than the accepted experimental and theoretical values.
Kamaratos, E.↗
Formation and destruction rates of interstellar H2
In the model of Hollenbach et al. (1971), hydrogen molecules are formed on grains. Molecular hydrogen is destroyed by absorption of radiation in the Lyman bands. A study has been conducted regarding the formation and destruction rates of molecular hydrogen. The ultraviolet radiation field has been calculated to determine the rate of molecular hydrogen destruction resulting from absorption in the Lyman bands. An estimate of an upper limit for the molecular hydrogen formation rate is obtained from observations involving stars in which very little molecular hydrogen is observed.
Jura, M.↗
CONTINUOUS ABSORPTION IN THE SOLAR ATMOSPHERE BY THE QUASI-H SUB 2 MOLECULE
Continuous absorption in solar atmosphere by quasi-hydrogen molecule
SOLAR ATMOSPHERE↗
Radiative corrections to the energies of atoms and molecules.
Approximation method using sum rules for energy shift in atomic system due to interaction of electrons with vacuum electromagnetic field applied to hydrogen, helium and lithium atom ground states and hydrogen molecule
HYDROGEN ATOM↗
Some potential-energy surfaces on H sub 3 super plus computed with generalized Gaussian orbitals.
Potential energy surfaces on triatomic hydrogen molecule ion computed with generalized Gaussian orbitals
TRIATOMIC MOLECULE↗
Intense Source of Polarized Hydrogen Atoms
Atoms produced by radio-frequency dissociation of hydrogen molecules sorted according to their hyperfine states in improved polarized hydrogen source. By use of combination of dc magnetic fields, atoms of upper hyperfine ground level selected in numbers greater than those of undesired F = O state. Source built with permanent magnets or electromagnets. Principal utility is source of polarized hydrogen for masers or experimental studies.
Maleki, L.↗
The Role of Grain Surface Reactions in the Chemistry of Star Forming Regions
The importance of reactions at the surfaces of dust grains has long been recognized to be one of the two main chemical processes that form molecules in cold, dark interstellar clouds where simple, saturated (fully-hydrogenated) molecules such as H2 water, methanol, H2CO, H2S, ammonia and CH4 are present in quantities far too high to be consistent with their extremely low gas phase formation rates. In cold dark regions of interstellar space, dust grains provide a substrate onto which gas-phase species can accrete and react. Grains provide a "third body" or a sink for the energy released in the exothermic reactions that form chemical bonds. In essence, the surfaces of dust grains open up alternative reaction pathways to form observed molecules whose abundances cannot be explained with gas-phase chemistry alone. This concept is taken one step further in this work: instead of merely acting as a substrate onto which radicals and molecules may physically adsorb, some grains may actively participate in the reaction itself, forming chemical bonds with the accreting species. Until recently, surface chemical reactions had not been thought to be important in warm circumstellar media because adspecies rapidly desorb from grains at very low temperatures; thus, the residence times of molecules and radicals on the surface of grains at all but the lowest temperatures are far too short to allow these reactions to occur. However, if the adspecies could adsorb more strongly, via a true chemical bond with surfaces of some dust grains, then grain surface reactions will play an important role in warm circumstellar regions as well. In this work, the surface-catalyzed reaction CO + 3 H2 yields CH4 + H2O is studied in the context that it may be very effective at converting the inorganic molecule CO into the simplest organic compound, methane. H2 and CO are the most abundant molecules in space, and the reaction converting them to methane, while kinetically inhibited in the gas phase under most astrophysical conditions, is catalyzed by iron, an abundant constituent of interstellar dust. At temperatures between 600 and 1000 K, which occur in the outflows from red giants and near luminous young stars, this reaction readily proceeds in the presence of an iron catalyst. Iron is one of the more abundant elements composing interstellar dust. Its abundance relative to hydrogen is almost that of silicon, and both of these heavy elements are primarily locked up in dust at all but the hottest regions of interstellar space.
Kress, M. E.↗
Interstellar clouds and molecular hydrogen
Data obtained from the Copernicus Orbiting Astronomical Observatory, launched in 1972 and still obtaining information, are used in a discussion of the interstellar medium. The Copernicus instruments have facilitated direct estimates for the density and temperature of individual interstellar clouds, and improved the ability to determine where along the line of sight a cloud lies with respect to background stars. The physical characteristics of hydrogen molecules are considered, with attention to the formation and destruction of interstellar hydrogen. The differences between 'thin' clouds, in which molecular hydrogen is optically thin, and 'thick' clouds are examined. Several features of the interstellar medium are described.
Jura, M.↗
Performance assessment of low pressure nuclear thermal propulsion
An increase in Isp for nuclear thermal propulsion systems is desirable for reducing the propellant requirements and cost of future applications, such as the Mars Transfer Vehicle. Several previous design studies have suggested that the Isp could be increased substantially with hydrogen dissociation/recombination. Hydrogen molecules (H2), at high temperatures and low pressures, will dissociate to monatomic hydrogen (H). The reverse process (i.e., formation of H2 from H) is exothermic. The exothermic energy in a nozzle increases the kinetic energy and therefore, increases the Isp. The low pressure nuclear thermal propulsion system (LPNTP) system is expected to maximize the hydrogen dissociation/recombination and Isp by operating at high chamber temperatures and low chamber pressures. The process involves hydrogen flow through a high temperature, low pressure fission reactor, and out a nozzle. The high temperature (approximately 3000 K) of the hydrogen in the reactor is limited by the temperature limits of the reactor material. The minimum chamber pressure is about 1 atm because lower pressures decrease the engines thrust to weight ratio below acceptable limits. This study assumes that hydrogen leaves the reactor and enters the nozzle at the 3000 K equilibrium dissociation level. Hydrogen dissociation in the reactor does not affect LPNTP performance like dissociation in traditional chemical propulsion systems, because energy from the reactor resupplies energy lost due to hydrogen dissociation. Recombination takes place in the nozzle due primarily to a drop in temperature as the Mach number increases. However, as the Mach number increases beyond the nozzle throat, the static pressure and density of the flow decreases and minimizes the recombination. The ideal LPNTP Isp at 3000 K and 10 psia is 1160 seconds due to the added energy from fast recombination rates. The actual Isp depends on the finite kinetic reaction rates which affect the amount of monatomic hydrogen recombination before the flow exits the nozzle. A LPNTP system has other technical issues (e.g. flow instability and two-phase flow) besides hydrogen dissociation/recombination which affect the systems practicality. In this study, only the effects of hydrogen dissociation/recombination are examined.
Gerrish, Harrold P., Jr.↗