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The Herschel Oxygen Project: Herschel Space Observatory Open Time Key Project

Topics include: Why oxygen and why at submillimeter wavelengths; gas phase chemistry for water, oxygen, and carbon monoxide is relatively simple; molecular oxygen structure; lower rotational levels and transitions of oxygen; oxygen abundance in interstellar clouds; SWAS spectra of terrestrial oxygen; what Herschel offers HOP; key regions for probing oxygen in the dense interstellar medium; HOP sources and strategy; and HOP data and analysis.

astrochemistry↗

The C-12/C-13 Ratio as a Chemistry Indicator

Isotopic ratios of elements are considered powerful tools, e.g. in tracing the origin of solar system body materials, or the degree of nucleosynthesis processing throughout the Galaxy. In interstellar molecules, some isotopic ratios like H/D and C-12/C-13 can also be used as indicators of their chemical origin. Isotope fractionation in gas-phase chemical reactions and gas-dust interaction makes observations of the ratio between C-12 and C-13 isotopologues suitable to distinguish between different formation scenarios. We will present observations of the C-12/C-13 ratio in methanol and formaldehyde towards a sample of embedded, massive young stellar objects. In relation to this we also present results from theoretical modeling showing the usefulness of the C-12/C-13 ratio as a chemistry indicator.

Wirstroem, Eva↗

Photoionization of cold gas phase coronene and its clusters: Autoionization resonances in monomer, dimer, and trimer and electronic structure of monomer cation

Polycyclic aromatic hydrocarbons (PAHs) are key species encountered in a large variety of environments such as the Interstellar Medium (ISM) and in combustion media. Their UV spectroscopy and photodynamics in neutral and cationic forms are important to investigate in order to learn about their structure, formation mechanisms, and reactivity. Here, we report an experimental photoelectron-photoion coincidence study of a prototypical PAH molecule, coronene, and its small clusters, in a molecular beam using the vacuum ultraviolet (VUV) photons provided by the SOLEIL synchrotron facility. Mass-selected high resolution threshold photoelectron (TPES) and total ion yield spectra were obtained and analyzed in detail. Intense series of autoionizing resonances have been characterized as originating from the monomer, dimer, and trimer neutral species, which may be used as spectral fingerprints for their detection in the ISM by VUV absorption spectroscopy. Finally, a full description of the electronic structure of the monomer cation was made and discussed in detail in relation to previous spectroscopic optical absorption data. Tentative vibrational assignments in the near-threshold TPES spectrum of the monomer have been made with the support of a theoretical approach based on density functional theory.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Modeling for Stellar Feedback in Galaxy Formation Simulations

Various heuristic approaches to model unresolved supernova (SN) feedback in galaxy formation simulations exist to reproduce the formation of spiral galaxies and the overall inefficient conversion of gas into stars. Some models, however, require resolution-dependent scalings. We present a subresolution model representing the three major phases of supernova blast wave evolution—free expansion, energy-conserving Sedov–Taylor, and momentum-conserving snowplow—with energy scalings adopted from high-resolution interstellar-medium simulations in both uniform and multiphase media. We allow for the effects of significantly enhanced SN remnant propagation in a multiphase medium with the cooling radius scaling with the hot volume fraction, f{sub hot}, as (1−f{sub hot}){sup −4/5}. We also include winds from young massive stars and AGB stars, Strömgren sphere gas heating by massive stars, and a mechanism that limits gas cooling that is driven by radiative recombination of dense H ii regions. We present initial tests for isolated Milky Way-like systems simulated with the Gadget-based code SPHgal with improved SPH prescription. Compared to pure thermal SN input, the model significantly suppresses star formation at early epochs, with star formation extended both in time and space in better accord with observations. Compared to models with pure thermal SN feedback, the age at which half the stellar mass is assembled increases by a factor of 2.4, and the mass-loading parameter and gas outflow rate from the galactic disk increase by a factor of 2. Simulation results are converged for a variation of two orders of magnitude in particle mass in the range (1.3–130) × 10{sup 4} solar masses.

79 ASTRONOMY AND ASTROPHYSICS↗

Dust and Gas in the Magellanic Clouds from the Heritage Herschel Key Project. I. Dust Properties and Insights into the Origin of the Submm (Submillimeter) Excess Emission

The dust properties in the Large and Small Magellanic Clouds are studied using the HERITAGE Herschel Key Project photometric data in five bands from 100 to 500 micromillimeters. Three simple models of dust emission were fit to the observations: a single temperature blackbody modified by a powerlaw emissivity (SMBB), a single temperature blackbody modified by a broken power-law emissivity (BEMBB), and two blackbodies with different temperatures, both modified by the same power-law emissivity (TTMBB). Using these models we investigate the origin of the submillimeter excess; defined as the submillimeter (submm) emission above that expected from SMBB models fit to observations < 200 micromillimeters. We find that the BEMBB model produces the lowest fit residuals with pixel-averaged 500 micromillimeters submillimeter excesses of 27% and 43% for the Large and Small Magellanic Clouds, respectively. Adopting gas masses from previous works, the gas-to-dust ratios calculated from our fitting results show that the TTMBB fits require significantly more dust than are available even if all the metals present in the interstellar medium (ISM) were condensed into dust. This indicates that the submillimeter excess is more likely to be due to emissivity variations than a second population of colder dust. We derive integrated dust masses of (7.3 plus or minus 1.7) x 10 (sup 5) and (8.3 plus or minus 2.1) x 10 (sup 4) solar masses for the Large and Small Magellanic Clouds, respectively. We find significant correlations between the submillimeter excess and other dust properties; further work is needed to determine the relative contributions of fitting noise and ISM physics to the correlations.

Magellanic↗

FORMING REALISTIC LATE-TYPE SPIRALS IN A {Lambda}CDM UNIVERSE: THE ERIS SIMULATION

Simulations of the formation of late-type spiral galaxies in a cold dark matter ({Lambda}CDM) universe have traditionally failed to yield realistic candidates. Here we report a new cosmological N-body/smooth particle hydrodynamic simulation of extreme dynamic range in which a close analog of a Milky Way disk galaxy arises naturally. Named 'Eris', the simulation follows the assembly of a galaxy halo of mass M{sub vir} = 7.9 Multiplication-Sign 10{sup 11} M{sub Sun} with a total of N = 18.6 million particles (gas + dark matter + stars) within the final virial radius, and a force resolution of 120 pc. It includes radiative cooling, heating from a cosmic UV field and supernova explosions (blastwave feedback), a star formation recipe based on a high gas density threshold (n{sub SF} = 5 atoms cm{sup -3} rather than the canonical n{sub SF} = 0.1 atoms cm{sup -3}), and neglects any feedback from an active galactic nucleus. Artificial images are generated to correctly compare simulations with observations. At the present epoch, the simulated galaxy has an extended rotationally supported disk with a radial scale length R{sub d} = 2.5 kpc, a gently falling rotation curve with circular velocity at 2.2 disk scale lengths of V{sub 2.2} = 214 km s{sup -1}, an i-band bulge-to-disk ratio B/D = 0.35, and a baryonic mass fraction within the virial radius that is 30% below the cosmic value. The disk is thin, has a typical H I-to-stellar mass ratio, is forming stars in the region of the {Sigma}{sub SFR}-{Sigma}{sub HI} plane occupied by spiral galaxies, and falls on the photometric Tully-Fisher and the stellar-mass-halo-virial-mass relations. Hot (T > 3 Multiplication-Sign 10{sup 5} K) X-ray luminous halo gas makes up only 26% of the universal baryon fraction and follows a 'flattened' density profile {proportional_to}r{sup -1.13} out to r = 100 kpc. Eris appears then to be the first cosmological hydrodynamic simulation in which the galaxy structural properties, the mass budget in the various components, and the scaling relations between mass and luminosity are all consistent with a host of observational constraints. A twin simulation with a low star formation density threshold results in a galaxy with a more massive bulge and a much steeper rotation curve, as in previously published work. A high star formation threshold appears therefore key in obtaining realistic late-type galaxies, as it enables the development of an inhomogeneous interstellar medium where star formation and heating by supernovae occur in a clustered fashion. The resulting outflows at high redshifts reduce the baryonic content of galaxies and preferentially remove low-angular-momentum gas, decreasing the mass of the bulge component. Simulations of even higher resolution that follow the assembly of galaxies with different merger histories shall be used to verify our results.

79 ASTRONOMY AND ASTROPHYSICS↗

A HST/WFC3-IR MORPHOLOGICAL SURVEY OF GALAXIES AT z = 1.5-3.6. II. THE RELATION BETWEEN MORPHOLOGY AND GAS-PHASE KINEMATICS

We analyze rest-frame optical morphologies and gas-phase kinematics as traced by rest-frame far-UV and optical spectra for a sample of 204 star-forming galaxies in the redshift range z {approx} 2-3 drawn from the Keck Baryonic Structure Survey. We find that spectroscopic properties and gas-phase kinematics are closely linked to morphology: compact galaxies with semimajor axis radii r {approx}< 2 kpc are substantially more likely than their larger counterparts to exhibit Ly{alpha} in emission. Although Ly{alpha} emission strength varies widely within galaxies of a given morphological type, all but one of 19 galaxies with Ly{alpha} equivalent width W {sub Ly{alpha}} > 20 A have compact and/or multiple-component morphologies with r {<=} 2.5 kpc. The velocity structure of absorption lines in the galactic continuum spectra also varies as a function of morphology. Galaxies of all morphological types drive similarly strong outflows (as traced by the blue wing of interstellar absorption line features), but the outflows of larger galaxies are less highly ionized and exhibit larger optical depth at the systemic redshift that may correspond to a decreasing efficiency of feedback in evacuating gas from the galaxy. This v {approx} 0 km s{sup -1} gas is responsible both for shifting the mean absorption line redshift and attenuating W {sub Ly{alpha}} (via a longer resonant scattering path) in galaxies with larger rest-optical half-light radii. In contrast to galaxies at lower redshifts, there is no evidence for a correlation between outflow velocity and inclination, suggesting that outflows from these puffy and irregular systems may be poorly collimated. Our observations are broadly consistent with theoretical models of inside-out growth of galaxies in the young universe, in which typical z {approx} 2-3 star-forming galaxies are predominantly unstable, dispersion-dominated, systems fueled by rapid gas accretion that later form extended rotationally supported disks when stabilized by a sufficiently massive stellar component.

79 ASTRONOMY AND ASTROPHYSICS↗

Far-infrared sources in Cygnus X - An extended emission complex at DR 21 and unresolved sources at S106 and ON 2

A new map of 90 micron emission with 15 arcmin resolution is presented of a complex of sources approximately centered on DR 21. The emission is primarily from diffuse sources. Comparison of the 90 micron map with maps at 20 microns and 2.7 GHz leads to a model for diffuse sources in which there are at least two components of interstellar dust, one at 40 K and one at 165 K, responsible for the 90 micron and 20 micron emission respectively. Both components and the ionized gas must be mixed together; dust in an outer neutral shell is relatively unimportant for these sources. The diffuse sources have small infrared excesses and weak temperature gradients. Unresolved, probably compact, sources were observed at S106 and ON 2 and are briefly discussed.

Campbell, M. F.↗

Laboratory studies of photodissociation processes relevant to the formation of cometary radicals

The strength of the C2(d 3 Pi g yields a 3 Pi u) Swan band emission in the spectra of cometary comae identifies this species as a prominent constituent of the coma gas. It was previously suggested that the formation of cometary C2 proceeds via the secondary photolysis of the C2H radical. The detection of C2H in the interstellar medium and the recent analysis of the radial variation in C2(delta V=O) surface brightness of Comet Halley support the postulate that C2 is a third-generation molecule. Measurement of the C2 and C2H translational energy distributions produced from the multiphoton dissociation (MPD) of acetylene at 193 nm are identified . Time-resolved FTIR emission studies of the nascent C2H radical formed in the C2H2 yields C2H + H reaction verify that this species is produced both vibrationally and electronically excited. A survey of the internal energy distributions of the C2 fragments produced from the MPD of acetylene using a high intensity ArF laser is currently in progress in the laboratory. Recent experiments have focused on the measurement of rotational energy distribution for the C2(A 1 Pi u, a 3 Pi u) fragments. The C2(a 3 Pi u) detection capability is currently being improved by performing this experiment in a molecular beam, thus allowing for discrimination between initial emission and laser-induced fluorescence (LIF). Although the experiments performed to date provide considerable evidence in support of C2H yields C2 + H reaction, there is an important distinction to be made when comparing the laboratory conditions to those typically found in comets. The C2H radicals generated in the laboratory experiments are formed vibrationally and/or electronically excited. Any rotationally/vibrationally excited C2H present in cometary comae will quickly undergo radiative relaxation in the infrared to their lowest rotational and vibrational state. Experiments are currently under way to confirm the cometary formation of C2 via the VUV dissociation of cold C2H.

Urdahl, R. S.↗

Numerical modeling of the interstellar medium in galactic disks

We have been developing detailed hydrodynamic models of the global interstellar medium in the hope of understanding the mass and volume occupied by various phases, as well as their structure and kinematics. In our model, the gas is modeled by one fluid while representative Pop 1 stars are modeled by a second fluid. The two fluids are coupled in that the gas forms into stars at a rate given by a Schmidt law while stellar mass loss returns matter into the gas phase (on a time scale of 100 Myr). Also, the stars heat the gas through stellar winds and the gas cools through optically thin radiation. The time behavior of these two fluids is studied in two spatial dimensions with the Eulerian finite difference numerical hydrodynamic code Zen. The two spatial dimensions are along the plane of a disk (x, total length of 2 kpc) and perpendicular to the disk (z, total height of +/- 15 kpc) and a galactic gravitational field in the z direction, typical of that at the solar circle, is imposed upon the simulation; self-gravity and rotation are absent. For the boundary conditions, outflow is permitted at the top and bottom of the grid (z = +/- 15 kpc) while periodic boundary conditions are imposed upon left and right sides of the grid. As initial conditions, we assumed a gaseous distribution like that seen for the H1 by earlier researchers, although the results are insensitive to the initial conditions. We have run simulations in which the heating due to stars, parameterized as a stellar wind velocity, a, is varied from low (a = 150 km/s), to intermediate (a = 300 km/s), to high (a = 600 km/s). Since the intermediate case is roughly equivalent to the Galactic energy injection rate from supernovae, this summary will concentrate on results from this simulation.

Rosen, A.↗

High redshift quasars and high metallicities

A large-scale code called Cloudy was designed to simulate non-equilibrium plasmas and predict their spectra. The goal was to apply it to studies of galactic and extragalactic emission line objects in order to reliably deduce abundances and luminosities. Quasars are of particular interest because they are the most luminous objects in the universe and the highest redshift objects that can be observed spectroscopically, and their emission lines can reveal the composition of the interstellar medium (ISM) of the universe when it was well under a billion years old. The lines are produced by warm (approximately 10(sup 4)K) gas with moderate to low density (n less than or equal to 10(sup 12) cm(sup -3)). Cloudy has been extended to include approximately 10(sup 4) resonance lines from the 495 possible stages of ionization of the lightest 30 elements, an extension that required several steps. The charge transfer database was expanded to complete the needed reactions between hydrogen and the first four ions and fit all reactions with a common approximation. Radiative recombination rate coefficients were derived for recombination from all closed shells, where this process should dominate. Analytical fits to Opacity Project (OP) and other recent photoionization cross sections were produced. Finally, rescaled OP oscillator strengths were used to compile a complete set of data for 5971 resonance lines. The major discovery has been that high redshift quasars have very high metallicities and there is strong evidence that the quasar phenomenon is associated with the birth of massive elliptical galaxies.

Ferland, Gary J.↗

The Unusual X-Ray Collision Morphology of NGC 4782/4783 (3C 278)

Deep ROSAT HRI (High-Resolution Imager) imaging of the X-ray-emitting gas associated with the colliding elliptical galaxy pair NGC 4782/4783 reveals for the first time the complexity of the hot gas distribution in a pair of close interacting galaxies. The HRI image of NGC 4782/4783 shows hot gas around each galaxy, a high surface brightness X-ray bridge connecting the galaxy pair, tidal-like tails emerging from the two galaxies, and a sheet of gas at the interaction interface between the two galaxies. The hot gas distributions do not peak at the optical centers of the galaxies but are displaced in the same sense as the tidal distensions seen in the optical luminosity distributions. All of these remarkable features show the complexity of structure that develops in the hot gas distribution when both hydrodynamical and tidal forces come into play during collisions between ellipticals with hot gas components. Models by Borne and Colina of the bent two-sided radio jet 3C 278 (associated with NGC 4782) indicated that there must be a strong interaction between the hot gas components of NGC 4782,/4783 and that the deflection of the radio jets is likely caused by the ram pressure exerted on the jet plasma by the hot gas associated with the passing companion NGC 4783. These conclusions are qualitatively confirmed by the HRI image and substantiate the major role played by the hot interstellar medium, and its asymmetries, in the propagation and entrainment of radio jets in colliding radio host ellipticals.

Colina, Luis↗

EXCITATION OF C{sub 2} IN DIFFUSE INTERSTELLAR CLOUDS

We investigate the effects and the implications of incorporating new collision and radiative rates in modeling the excitation of diatomic carbon molecule. The present results suggest that diffuse and translucent interstellar clouds may present a structure in which regions with different densities and kinetic temperatures overlap along the line of sight, such as core-halo clouds, the nested structure of the molecular gas, and clumpiness. Such conclusion reflects the response of the C{sub 2} rotational ladder to the interplay of thermal and radiative conditions, with low and high rotational levels tracing different regions of the parameter space. To relieve constraints to the formation and excitation of C{sub 2} molecules, we propose a scenario in which the chemistry in diffuse clouds is supplemented by chemistry in many transient and tiny perturbations.

79 ASTRONOMY AND ASTROPHYSICS↗

Chemistry of nitrile anions in the interstellar medium

Despite the extreme conditions of temperature (down to 10K) and density (down to 100 molecules/cm{sup 3}), the giant molecular clouds and the circumstellar envelopes present a rich and complex chemistry. To date, more than 180 molecules have been detected in the InterStellar Medium (ISM) with a large abundance of nitriles (RC≡N). In addition, several anions have been recently observed in this medium: C{sub 4}H{sup ¯}, C{sub 6}H{sup ¯}, C{sub 8}H{sup ¯}, CN{sup ¯}, C{sub 3}N{sup ¯} and C{sub 5}N{sup ¯}. These last species should play a key role in the molecular growth towards complexity. To explore this hypothesis, their reactivity must be studied in the laboratory. The FALP-MS and the CRESU experimental apparatuses of the Rennes University are able to measure absolute rate coefficient of various chemical reactions, including the ion – molecule reactions, in gas phase at low temperature (from 300K for the FALP-MS down to 15K for the CRESU). Therefore, these experimental tools are particularly adapted to the kinetic studies of reactions potentially involved in the Interstellar Medium. One of the difficulties encountered in experiments with anions is their generation. We describe here the formation of the CN{sup ¯} and C{sub 3}N{sup ¯} anions by dissociative electron attachment on the molecular precursors BrCN and BrC{sub 3}N.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Collaborative Research: A Model of Partially Ionized Plasma Flows with Kinetic Treatment of Neutral Atoms and Nonthermal Ions

Interactions of flows of partially ionized, magnetized plasma are frequently accompanied by the presence of both thermal and non-thermal (pickup) ion components. Such interactions cannot be modeled using traditional MHD equations and require more advanced approaches to treat them. If a nonthermal component of ions is formed due to charge exchange and collisions between the thermal (core) ions and neutrals, it experiences the action of magnetic field, its distribution function is isotropized, and it soon acquires the velocity of the ambient plasma without being thermodynamically equilibrated. This situation, e. g., takes place in the outer heliosphere –- the part of interstellar space beyond the solar system whose properties are determined by the solar wind interaction with the local interstellar medium. This is also possible in laboratory, at million degrees and above, when plasma is conducting electricity far too well, which makes Ohmic heating ineffective. To attain the target temperatures one needs additional heating eventually playing a dominant role. Among such sources is a so-called neutral particle beam heating. This is a wide-spread technique (Joint European Torus and International Thermonuclear Experimental Reactor experiments) based on the injection of powerful beams of neutral atoms into ohmically preheated plasma. In this project we have investigated the energy and density separation between the thermal and nonthermal components in the solar wind and interstellar plasmas. A new model has been developed in which we solve the ideal MHD equations for mixture of all ions and the kinetic Boltzmann equation to describe the transport of neutral atoms. As a separate capability, we can treat the flow of neutral atoms in a multi-component fashion, where neutral atoms born in each thermodynamically distinct region are governed by the Euler gas dynamic equations. We also describe the behavior of pickup ions either kinetically, using the Fokker--Planck equation, or as a separate fluid. Our numerical simulations have demonstrated that pickup ions play a major role in the interaction of the solar wind and (partially ionized) interstellar medium plasmas. Our teams have investigated the stability of the surface (the heliopause) that separates the solar wind from the local interstellar medium, the transport of galactic cosmic rays, the properties of the heliotail flow, and modifications to the bow wave in front of the heliopause due to charge exchange between the neutral H atoms born in the solar wind and interstellar ions. Modeling results have been validated against observational data, such as obtained by the Interstellar Boundary Explorer (IBEX), and made it possible to shed light on the structure of energetic neutral atom maps created by this spacecraft.. We have also demonstrated that charge-exchange modulated heliosphere is a source of anisotropy of the multi-TeV cosmic ray flux observed in a number of Earth-bound air shower experiments. Newly developed codes are implemented within a Multi-Scale Fluid-Kinetic Simulation Suite (MS-FLUKSS), a publicly available code being developed by our team for over 12 years. MS-FLUKSS scales well up to 160,000 computing cores and has been ported on major supercomputers in the country. Efficient parallelization and data choreography in the continuum simulation modules are provided by Chombo, an adaptive mesh refinement framework managed by Phillip Colella's team at LBNL. We have implemented in-house, hybrid (MPI+OpenMP) parallelization of the kinetic modules that solve the Boltzmann equation with a Monte Carlo method. Currently, the kinetic modules are being rewritten to take advantage of the modern CPU-GPU supercomputer architecture. The scope of the project allowed us to enhance plasma research and education in such broad, multidisciplinary field as physics of partially ionized plasma and its application to space physics and fusion science. Besides the impact on the modeling of complex physical systems, our approach to computational resource management for complex codes utilizing multiple algorithm technologies appears to be a major advance on current approaches. The development of sophisticated resource management will be essential for all future modeling efforts that incorporate a diversity of scales and physical processes. Our effort provided leadership in promoting computational science and plasma physics within the UAH and FIT campuses and, through the training of a broad spectrum of scientists and engineers, fostering new technologies across the country.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Collaborative Research: A Model of Partially Ionized Plasma Flows with Kinetic Treatment of Neutral Atoms and Nonthermal Ions

Interactions of flows of partially ionized, magnetized plasma are frequently accompanied by the presence of both thermal and non-thermal (pickup) ion components. Such interactions cannot be modeled using traditional MHD equations and require more advanced approaches to treat them. If a nonthermal component of ions is formed due to charge exchange and collisions between the thermal (core) ions and neutrals, it experiences the action of magnetic field, its distribution function is isotropized, and it soon acquires the velocity of the ambient plasma without being thermodynamically equilibrated. This situation, e. g., takes place in the outer heliosphere - the part of interstellar space beyond the solar system whose properties are determined by the solar wind interaction with the local interstellar medium. This is also possible in laboratory, at million degrees and above, when plasma is conducting electricity far too well, which makes Ohmic heating ineffective. To attain the target temperatures one needs additional heating eventually playing a dominant role. Among such sources is a so-called neutral particle beam heating. This is a wide-spread technique (Joint European Torus and International Thermonuclear Experimental Reactor experiments) based on the injection of powerful beams of neutral atoms into ohmically preheated plasma. In this project we have investigated the energy and density separation between the thermal and nonthermal components in the solar wind and interstellar plasmas. A new model has been developed in which we solve the ideal MHD equations for mixture of all ions and the kinetic Boltzmann equation to describe the transport of neutral atoms. As a separate capability, we can treat the flow of neutral atoms in a multi-component fashion, where neutral atoms born in each thermodynamically distinct regions are governed by the Euler gas dynamic equations. We also describe the behavior of pickup ions either kinetically, using the Fokker–Planck equation, or as a separate fluid. Our numerical simulations have demonstrated that pickup ions play a major role in the interaction of the solar wind and (partially ionized) interstellar medium plasmas. Our teams have investigated the stability of the surface (the heliopause) that separates the solar wind from the local interstellar medium, the transport of galactic cosmic rays, the properties of the heliotail flow, and modifications to the bow wave in front of the heliopause due to charge exchange between the neutral H atoms born in the solar wind and interstellar ions. Modeling results have been validated against observational data, such as obtained by the Interstellar Boundary Explorer (IBEX), and made it possible to shed light on the structure of energetic neutral atom maps created by this spacecraft.. We have also demonstrated that charge-exchange modulated heliosphere is a source of anisotropy of the multi-TeV cosmic ray flux observed in a number of Earth-bound air shower experiments. Newly developed codes are implemented within a Multi-Scale Fluid-Kinetic Simulation Suite (MS-FLUKSS), a publicly available code being developed by our team for over 12 years. MS-FLUKSS scales well up to 160,000 computing cores and has been ported on major supercomputers in the country. Efficient parallelization and data choreography in the continuum simulation modules are provided by Chombo, an adaptive mesh refinement framework managed by Phillip Colella’s team at LBNL. We have implemented in-house, hybrid (MPI+OpenMP) parallelization of the kinetic modules that solve the Boltzmann equation with a Monte Carlo method. Currently, the kinetic modules are being rewritten to take advantage of the modern CPU-GPU supercomputer architecture. The scope of the project allowed us to enhance plasma research and education in such broad, multidis- ciplinary field as physics of partially ionized plasma and its application to space physics and fusion science. Besides the impact on the modeling of complex physical systems, our approach to computational resource management for complex codes utilizing multiple algorithm technologies appears to be a major advance on current approaches. The development of sophisticated resource management will be essential for all future modeling efforts that incorporate a diversity of scales and physical processes. Our effort provided leadership in promoting computational science and plasma physics within the UAH and FIT campuses and, through the training of a broad spectrum of scientists and engineers, foster new technologies across the country.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

INTERSTELLAR SOLID HYDROGEN

We consider the possibility that solid molecular hydrogen is present in interstellar space. If so cosmic-rays and energetic photons cause ionization in the solid leading to the formation of H{sup +}{sub 6}. This ion is not produced by gas-phase reactions and its radiative transitions therefore provide a signature of solid H{sub 2} in the astrophysical context. The vibrational transitions of H{sup +}{sub 6} are yet to be observed in the laboratory, but we have characterized them in a quantum-theoretical treatment of the molecule; our calculations include anharmonic corrections, which are large. Here we report on those calculations and compare our results with astronomical data. In addition to the H{sup +}{sub 6} isotopomer, we focus on the deuterated species (HD){sup +}{sub 3} which is expected to dominate at low ionization rates as a result of isotopic condensation reactions. We can reliably predict the frequencies of the fundamental bands for five modes of vibration. For (HD){sup +}{sub 3} all of these are found to lie close to some of the strongest of the pervasive mid-infrared astronomical emission bands, making it difficult to exclude hydrogen precipitates on observational grounds. By the same token these results suggest that (HD){sup +}{sub 3} could be the carrier of the observed bands. We consider this possibility within the broader picture of interstellar medium photo-processes and we conclude that solid hydrogen may indeed be abundant in astrophysical environments.

79 ASTRONOMY AND ASTROPHYSICS↗

Large scale dissociation of molecular gas in the sprial arms of M51

The distribution of the atomic and ionized hydrogen along the inner spiral arms of M51 are compared. As is the case in M83, the location of both these phases of the interstellar medium with respect to the major dust lanes suggests that molecular hydrogen is dissociated on kpc scales in active star-forming regions, and that this dissociation process may strongly affect the observed morphology of atomic hydrogen in spiral arms.

Tilanus, R. P. J.↗