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NASA NTRS2012

Iridium Interfacial Stack - IrIS

Iridium Interfacial Stack (IrIS) is the sputter deposition of high-purity tantalum silicide (TaSi2-400 nm)/platinum (Pt-200 nm)/iridium (Ir-200 nm)/platinum (Pt-200 nm) in an ultra-high vacuum system followed by a 600 C anneal in nitrogen for 30 minutes. IrIS simultaneously acts as both a bond metal and a diffusion barrier. This bondable metallization that also acts as a diffusion barrier can prevent oxygen from air and gold from the wire-bond from infiltrating silicon carbide (SiC) monolithically integrated circuits (ICs) operating above 500 C in air for over 1,000 hours. This TaSi2/Pt/Ir/Pt metallization is easily bonded for electrical connection to off-chip circuitry and does not require extra anneals or masking steps. There are two ways that IrIS can be used in SiC ICs for applications above 500 C: it can be put directly on a SiC ohmic contact metal, such as Ti, or be used as a bond metal residing on top of an interconnect metal. For simplicity, only the use as a bond metal is discussed. The layer thickness ratio of TaSi2 to the first Pt layer deposited thereon should be 2:1. This will allow Si from the TaSi2 to react with the Pt to form Pt2Si during the 600 C anneal carried out after all layers have been deposited. The Ir layer does not readily form a silicide at 600 C, and thereby prevents the Si from migrating into the top-most Pt layer during future anneals and high-temperature IC operation. The second (i.e., top-most) deposited Pt layer needs to be about 200 nm to enable easy wire bonding. The thickness of 200 nm for Ir was chosen for initial experiments; further optimization of the Ir layer thickness may be possible via further experimentation. Ir itself is not easily wire-bonded because of its hardness and much higher melting point than Pt. Below the iridium layer, the TaSi2 and Pt react and form desired Pt2Si during the post-deposition anneal while above the iridium layer remains pure Pt as desired to facilitate easy and strong wire-bonding to the SiC chip circuitry.

Spry, David↗
NASA NTRS2012

Titan Aerosol Analogs from Aromatic Precursors: Comparisons to Cassini CIRS Observations in the Thermal Infrared

Since Cassini's arrival at Titan, ppm levels of benzene (C6H6) as well as large positive ions, which may be polycyclic aromatic hydrocarbons (PAHs). have been detected in the atmosphere. Aromatic molecules. photolytically active in the ultraviolet, may be important in the formation of the organic aerosol comprising the Titan haze layer even when present at low mixing ratios. Yet there have not been laboratory simulations exploring the impact of these molecules as precursors to Titan's organic aerosol. Observations of Titan by the Cassini Composite Infrared Spectrometer (CIRS) in the far-infrared (far-IR) between 560 and 20/cm (approx. 18 to 500 microns) and in the mid-infrared (mid-IR) between 1500 and 600/cm (approx. 7 to 17 microns) have been used to infer the vertical variations of Titan's aerosol from the surface to an altitude of 300 km in the far-IR and between 150 and 350 km in the mid-IR. Titan's aerosol has several observed emission features which cannot be reproduced using currently available optical constants from laboratory-generated Titan aerosol analogs, including a broad far-IR feature centered approximately at 140/cm (71 microns).

Trainer, Melissa G.↗
NASA NTRS2017

Infrared Continuum and Line Evolution of the Equatorial Ring Around SN 1987A

Spitzer observations of SN 1987A have now spanned more than a decade. Since day approximately 4000, mid-infrared (mid-IR) emission has been dominated by that from shock-heated dust in the equatorial ring (ER). From 6000 to 8000 days after the explosion, Spitzer observations included broadband photometry at 3.6-24 micrometer, and low and moderate resolution spectroscopy at 5-35 micrometer. Here we present later Spitzer observations, through day 10,377, which include only the broadband measurements at 3.6 and 4.5 micrometer. These data show that the 3.6 and 4.5 micrometer brightness has clearly begun to fade after day approximately 8500, and no longer tracks the X-ray emission as well as it did at earlier epochs. This can be explained by the destruction of the dust in the ER on timescales shorter than the cooling time for the shocked gas. We find that the evolution of the late time IR emission is also similar to the now fading optical emission. We provide the complete record of the IR emission lines, as seen by Spitzer prior to day 8000. The past evolution of the gas as seen by the IR emission lines seems largely consistent with the optical emission, although the IR [Fe(II)]and [Si(II)]lines show different, peculiar velocity structures.

Arendt, Richard G.↗
NASA NTRS2016

Retrieval of Ice Cloud Properties Using an Optimal Estimation Algorithm and MODIS Infrared Observations: 2. Retrieval Evaluation

An infrared-based optimal estimation (OE-IR) algorithm for retrieving ice cloud properties is evaluated. Specifically, the implementation of the algorithm with MODerate resolution Imaging Spectroradiometer (MODIS) observations is assessed in comparison with the operational retrieval products from MODIS on the Aqua satellite (MYD06), Cloud-Aerosol Lidar with Orthogonal Polarization (CALIOP), and the Imaging Infrared Radiometer (IIR); the latter two instruments fly on the Cloud-Aerosol Lidar and Infrared Pathfinder Satellite Observation (CALIPSO) satellite in the Afternoon Constellation (A-Train) with Aqua. The results show that OE-IR cloud optical thickness (tau) and effective radius (r(sub eff)) retrievals perform best for ice clouds having 0.5 < tau< 7 and r(sub eff) < 50microns. For global ice clouds, the averaged retrieval uncertainties of tau and r(sub eff) are 19% and 33%, respectively. For optically thick ice clouds with tau larger than 10, however, the tau and r(sub eff) retrieval uncertainties can exceed 30% and 50%, respectively. For ice cloud top height (h), the averaged global uncertainty is 0.48km. Relatively large h uncertainty (e.g., > 1km) occurs for tau < 0.5. Analysis of 1month of the OE-IR retrievals shows large tau and r(sub eff) uncertainties in storm track regions and the southern oceans where convective clouds are frequently observed, as well as in high-latitude regions where temperature differences between the surface and cloud top are more ambiguous. Generally, comparisons between the OE-IR and the operational products show consistent tau and h retrievals. However, obvious differences between the OE-IR and the MODIS Collection 6 r(sub eff) are found.

cloud optics↗
NASA NTRS2017

Utilizing the Precessing Orbit of TRMM to Produce Hourly Corrections of Geostationary Infrared Imager Data with the VIRS Sensor

Accurate characterization of the Earth's radiant energy is critical for many climate monitoring and weather forecasting applications. For example, groups at the NASA Langley Research Center rely on stable visible- and infrared-channel calibrations in order to understand the temporal/spatial distribution of hazardous storms, as determined from an automated overshooting convective top detection algorithm. Therefore, in order to facilitate reliable, climate-quality retrievals, it is important that consistent calibration coefficients across satellite platforms are made available to the remote sensing community, and that calibration anomalies are recognized and mitigated. One such anomaly is the infrared imager brightness temperature (BT) drift that occurs for some Geostationary Earth Orbit satellite (GEOsat) instruments near local midnight. Currently the Global Space-Based Inter-Calibration System (GSICS) community uses the hyperspectral Infrared Atmospheric Sounding Interferometer (IASI) sensor as a common reference to uniformly calibrate GEOsat IR imagers. However, the combination of IASI, which has a 21:30 local equator crossing time (LECT), and hyperspectral Atmospheric Infrared Sounder (AIRS; 01:30 LECT) observations are unable to completely resolve the GEOsat midnight BT bias. The precessing orbit of the Tropical Rainfall Measuring Mission (TRMM) Visible and Infrared Scanner (VIRS), however, allows sampling of all local hours every 46 days. Thus, VIRS has the capability to quantify the BT midnight effect observed in concurrent GEOsat imagers. First, the VIRS IR measurements are evaluated for long-term temporal stability between 2002 and 2012 by inter-calibrating with Aqua-MODIS. Second, the VIRS IR measurements are assessed for diurnal stability by inter-calibrating with Meteosat-9 (Met-9), a spin-stabilized GEOsat imager that does not manifest any diurnal dependency. In this case, the Met-9 IR imager is first adjusted with the official GSICS calibration coefficients. Then VIRS is used as a diurnal calibration reference transfer to produce hourly corrections of GEOsat IR imager BT. For the 9 three-axis stabilized GEO imagers concurrent with VIRS, the midnight effect increased the BT on average by 0.5 K (11 microns) and 0.4 K (12 microns), with a peak at approx.01:00 local time. As expected, the spin-stabilized GEOsats revealed a smaller diurnal temperature cycle (mostly < 0.2 K) with inconsistent peak hours.

Scarino, Benjamin↗
NASA NTRS2018

Delayed Shock-Induced Dust Formation in the Dense Circumstellar Shell Surrounding the Type IIn Supernova SN 2010jl

The light curves of Type IIn supernovae are dominated by the radiative energy released through the interaction of the supernova shock waves with their dense circumstellar medium (CSM). The ultraluminous Type IIn supernova SN2010jl exhibits an infrared emission component that is in excess of the extrapolated UV-optical spectrum as early as few weeks postexplosion. This emission has been considered by some as evidence for the rapid formation of dust in the cooling postshock CSM. We investigate the physical processes that may inhibit or facilitate the formation of dust in the CSM. When only radiative cooling is considered, the temperature of the dense shocked gas rapidly drops below the dust condensation temperature. However, by accounting for the heating of the postshock gas by the downstream radiation from the shock, we show that dust formation is inhibited until the radiation from the shock weakens as it propagates into the less dense outer regions of the CSM. In SN2010jl, dust formation can therefore only commence after day ∼380. Only the IR emission since that epoch can be attributed to the newly formed CSM dust. Observations on day 460 and later show that the IR luminosity exceeds the UV-optical luminosity. The postshock dust cannot extinct the radiation emitted by the expanding SN shock. Therefore, its IR emission must be powered by an interior source, which we identify as the reverse shock propagating through the SN ejecta. IR emission before day 380 must therefore be an IR echo from preexisting CSM dust.

Sarangi, Arkaprabha↗
NASA NTRS2014

Oxidative Stress Responses to Simulated Spaceflight in Mineralized and Marrow Compartments of Bone and Associated Vasculature

Long-term spaceflight causes profound changes to the musculoskeletal system attributable to unloading and fluid shifts in microgravity. Future space explorations beyond the earth’s magnetosphere will expose astronauts to space radiation, which may cause additional skeletal deficits that are not yet fully understood. Our long-term goals are twofold: to define the mechanisms and risk of bone loss in the spaceflight environment and to facilitate the development of effective countermeasures if necessary. Our central hypothesis is that oxidative stress plays a key role in progressive bone loss and vascular dysfunction caused by spaceflight. In animal’s models, overproduction of free radicals is associated with increased bone resorption, lower bone formation, and decrements in bone mineral density and structure which can ultimately lead to skeletal fragility. Evidence in support of a possible causative role for oxidative stress in spaceflight-induced bone loss derive from knockout and transgenic mouse studies and the use of pharmacological interventions with known anti-oxidant properties. In our studies to simulate spaceflight, 16-wk old, male C56Bl/6J mice were assigned to one of four groups: hind limb unloading to simulate weightlessness (HU), normally loaded Controls (‘NL’) (sham irradiated, no hind limb unloading), irradiated at NASA Space Radiation Laboratory ‘IR’ with 1-2Gy of (600MeV/n) alone, or in combination with protons (0.5Gy Protons/0.5Gy 56Fe), (IR) or both hind limb unloaded and irradiated, ‘HU+IR’. Mice were exposed to radiation 3 days after initiating HU and tissues harvested were 1-14 days after initiating treatments for analyses. Results from our laboratories, which employ various biochemical, gene expression, functional, and transgenic animal model methods, implicate dynamic regulation of redox-related pathways by spaceflight-related environmental factors. As one example, we found that combined HU and radiation exposure caused oxidative damage in skeletal tissues (lipid peroxidation) of wildtype mice, whereas bone from transgenic mice that overexpress human catalase in mitochondria were protected. Interestingly, marrow cells grown under culture conditions that select for endothelial progenitor cells (EPC), showed that HU but not IR reduced EPC cell migration; in contrast HU and IR each inhibited growth of marrow-derived osteoblast progenitors. Taken together, these results indicate that unloading and ionizing elicit distinct effects on progenitor and mature cells of vascular and skeletal tissue, and that oxidative damage may contribute to skeletal and vascular deficits that may emerge during extended space travel.

Globus, R. K.↗
NASA NTRS2018

Variability of Disk Emission in Pre-Main-Sequence and Related Stars. IV. Investigating the Structural Changes in the Inner Disk Region of MWC 480

We present five epochs of near-IR observations of the protoplanetary disk around MWC 480 (HD 31648) obtained with the SpeX spectrograph on NASA’s Infrared Telescope Facility between 2007 and 2013, inclusive. Using the measured line fluxes in the Pa β and Br γ lines, we found the mass accretion rates to be (1.26–2.30) x 10(exp −7) Solar Mass/yr and (1.4–2.01) x 10(exp −7) Solar Mass/yr, respectively, but which varied by more than 50% from epoch to epoch. The spectral energy distribution reveals a variability of about 30% between 1.5 and 10 μm during this same period of time. We investigated the variability using of the continuum emission of the disk in using the Monte- Carlo Radiative Transfer Code HOCHUNK3D. We find that varying the height of the inner rim successfully produces a change in the NIR flux but lowers the far-IR emission to levels below all measured fluxes. Because the star exhibits bipolar flows, we utilized a structure that simulates an inner disk wind to model the variability in the near-IR, without producing flux levels in the far-IR that are inconsistent with existing data. For this object, variable near-IR emission due to such an outflow is more consistent with the data than changing the scale height of the inner rim of the disk.

Fernandes, Rachel B.↗
NASA NTRS2016

Effects of Hindlimb Unloading and Ionizing Radiation on Murine Gene Expression in Skin and Bone

Long duration spaceflight causes a negative calcium balance and reduces bone density in astronauts. The underlying mechanisms of spaceflight-induced bone loss and the possible influences of both microgravity and radiation are not fully understood although emerging evidence suggests that these two factors may interact to result in increased bone loss. Previously, gene expression analysis of hair follicles from astronauts, as well as skin from space-flown mice, revealed changes in the expression of genes related to DNA damage and oxidative stress responses. These results resemble the responses of bone to spaceflight-like radiation and simulated weightlessness by hindlimb unloading (HU). Hence in this study, we initiated studies to determine whether skin can be used to predict the responses of bone to simulated microgravity and radiation. We examined oxidative stress and growth arrest pathways in mouse skin and long bones by measuring gene expression levels via quantitative polymerase chain reaction (qPCR). To investigate the effects of irradiation andor HU on gene expression, we used skin and femora (cortical shaft) from the following treatment groups: control (normally loaded, sham-irradiated) (CT), hindlimb unloading (HU), 56Fe radiation (IR) and both HU+IR. Animals were euthanized 11 days post-IR, and results were analyzed by 1-way ANOVA. In skin samples, Cdkn1a was decreased to the same extent in HU and HU+IR (47 of CT). In addition, HU reduced FoxO3 expression (46 of CT) and IR increased Gadd45g expression 135 compared CT in skin. But in bone, HU increased FoxO3 expression 31 compared the level of CT. These results suggest that radiation and simulated weightlessness regulated simliar oxidative stress and cell cycle arrest genes in both skin and bone, although the time course and direction of changes may differ. This research may lead to the development of a relatively simple diagnostic tool for bone loss with the advantage that hair follicles and skin are relatively easy to acquire from subjects.

Terada, Masahiro↗
NASA NTRS2019

Principal Component Analysis of Up-The-Ramp Sampled Infrared Array Data

We describe the results of principal component analysis (PCA) of up-the-ramp sampled infrared (IR) array data from the Hubble Space Telescope wide field camera 3 (WFC3 IR), James Webb Space Telescope NIRSpec, and prototype Wide Field Infrared Survey Telescope’s wide field instrument detectors. These systems use, respectively, Teledyne H1R, H2RG, and H4RG-10 near-IR detector arrays with a variety of IR array controllers. The PCA shows that the Legendre polynomials approximate the principal components of these systems (i.e., they roughly diagonalize the covariance matrix). In contrast to the monomial basis that is widely used for polynomial fitting and linearization today, the Legendre polynomials are an orthonormal basis. They provide a quantifiable, compact, and (nearly) linearly uncorrelated representation of the information content of the data. By fitting a few Legendre polynomials, nearly all of the meaningful information in representative WFC3 astronomical datacubes can be condensed from 15 up-the-ramp samples down to 6 compressible Legendre coefficients per pixel. The higher order coefficients contain time domain information that is lost when one projects up-the-ramp sampled datacubes onto two-dimensional images by fitting a straight line, even if the data are linearized before fitting the line. Going forward, we believe that this time domain information is potentially important for disentangling the various nonlinearities that can affect IR array observations, i.e., inherent pixel nonlinearity, persistence, burn in, brighter-fatter effect, (potentially) nonlinear interpixel capacitance, and perhaps others.

Rauscher, Bernard J.↗
NASA NTRS2018

Virtual Sensors Determined Through Machine Learning

We propose a method that increases the capability of a conventional sensor, transforming it into an enhanced virtual sensor. This paper focuses on a virtual thermal Infrared Radiation (IR) sensor based on a conventional visual (RGB) sensor. The estimation of thermal IR images can enhance the ability of terrain classification, which is crucial for autonomous navigation of rovers. The estimate in IR from visual band has inherent limitations, as these are different bands, yet correlations between visual RGB and thermal IR images exist, as different terrains, which visually may appear different, also have different thermal inertia. This paper describes the developed deep learning-based algorithm that estimates thermal IR images from RGB images of terrains, providing the feasibility of the idea with average 1.21 error [degree Celsius].

Torresen, Jim↗
NASA NTRS2018

Virtual Sensors Determined Through Machine Learning

We propose a method that increases the capability of a conventional sensor/instrument, transforming it into an enhanced virtual sensor/instrument. This paper focuses on a virtual thermal IR sensor based on a conventional visual (RGB) sensor. The estimation of thermal IR images can enhance the ability of terrain classification, which is crucial for autonomous navigation of rovers. The estimate in IR from visual band has inherent limitations, as these are different bands, yet correlations between visual/RGB and thermal IR images exist, as different terrains, which visually may appear different, also have different thermal inertia. We developed a deep learning-based algorithm that estimates thermal IR images from RGB images of terrains, providing the feasibility of the idea with average 1.21 error [degree].

Kurazume, Ryo↗
NASA NTRS2019

The CANDELS/SHARDS Multi-Wavelength Catalog in GOODS-N: Photometry, Photometric Redshifts, Stellar Masses, Emission Line Fluxes and Star Formation Rates

We present a WFC3 F160W (H-band) selected catalog in the CANDELS/GOODS-N field containing photometry from the ultraviolet (UV) to the far-infrared (IR), photometric redshifts and stellar pa-rameters derived from the analysis of the multi-wavelength data. The catalog contains 35,445 sourcesover the 171 arcmin2of the CANDELS F160W mosaic. The 5σdetection limits (within an aperture ofradius 0.′′17) of the mosaic range betweenH= 27.8, 28.2 and 28.7 in the wide, intermediate and deepregions, that span approximately 50%, 15% and 35% of the total area. The multi-wavelength photom-etry includes broad-band data from UV (U band from KPNO and LBC), optical (HST/ACS F435W,F606W, F775W, F814W, and F850LP), near-to-mid IR (HST/WFC3 F105W, F125W, F140W andF160W, Subaru/MOIRCS Ks, CFHT/Megacam K, andSpitzer/IRAC 3.6, 4.5, 5.8, 8.0μm) and far IR(Spitzer/MIPS 24μm, HERSCHEL/PACS 100 and 160μm, SPIRE 250, 350 and 500μm) observations.In addition, the catalog also includes, optical medium-band data (R∼50) in 25 consecutive bands,λ= 500 to 950 nm, from the SHARDS survey and WFC3 IR spectroscopic observations with theG102 and G141 grisms (R∼210 and 130). The use of higher spectral resolution data to estimate pho-tometric redshifts provides very high, and nearly uniform, precision fromz= 0−2.5. The comparisonto 1,485 good quality spectroscopic redshifts up toz∼3 yields ∆z/(1+zspec)=0.0032 and an outlierfraction ofη=4.3%. In addition to the multi-band photometry, we release added-value catalogs withemission line fluxes, stellar masses, dust attenuations, UV- and IR-based star formation rates andrest-frame colors.

Guillermo Barro↗
NASA NTRSDate not supplied

Oxidative Stress and Neuroconsequences of the Spaceflight Environment –A 5-ion GCRsim Dose-response Study

The overall scope of this project is to test the hypothesis that Ionizing Radiation (IR), microgravity and social isolation combine synergistically to trigger an oxidative stress response that alters immune homeostasis, brain structure/function, and neurobehavioral/cognitive performance. Specific Aims for this project are to: (1) Determine dose-response curves for acute ‘Five-Ion GCR Simulation’ exposure for immune, brain and performance responses in crew age-matched adult male and female mice; (2) Determine effects of acute ‘Five-Ion GCR Simulation’ exposure singly and in combination with simulated microgravity and social isolation, on immune, brain and performance responses in crew age-matched male and female mice mimicking deep space missions; and (3) Determine efficacy of the dietary antioxidant, Nicotinamide Mononucleotide (NMN), a key intermediate in nicotinamide adenine dinucleotide (NAD+) biosynthesis. Here we exposed mature (23-24-week-old) male and female mice to simulated 5-Ion GCR (either 0, 5, 15, or 50cGy) at the NASA Space Radiation Laboratory (NSRL). Across ‘Acute’ (IR+72hrs and IR+14 days) and ‘Delayed’ (IR+28 to IR+124 days) phases of the 6-month-long study, we assessed immune, neural, and functional (sensorimotor/behavioral/cognitive) responses anticipated during a transit to Mars. This presentation will report on dose-response curves for 5-ion GCRsim related to potential biomarkers; structural/functional changes in the immune and nervous systems; and behavioral/cognitive performance deficits. This project addresses NASA’s efforts to characterize risks and identify appropriate countermeasures in anticipation of future deep space missions. Ensuring crew health and performance during extended transits necessitates that sensorimotor and cognitive abilities remain strong to avoid potentially catastrophic health and safety outcomes.

deep space↗
NASA NTRS2022

The breakup of a long-period comet is not a likely match to the Chicxulub impactor

Since the discovery of Ir in the clay layer at the K-Pg boundary, scientists have sought to constrain the origin of the extraterrestrial impactor that triggered the end-Cretaceous mass extinction of the non-avian dinosaurs and other species. While the first proposal was for an asteroid, for a while some theories invoked a cometary impactor to explain perceived periodicities in mass extinctions. Such models have long been disfavored by the mass of Ir in the layer, inferred to be 2.0−2.8×10^(11)cu.g. The size of the Chicxulub crater leads to an estimated asteroid impactor diameter, D≈10km. Comets typically impact at higher speeds, reducing the impactor mass for the same impact energy. Although it is increasingly recognized that a continuum exists between comets and asteroids, ’comets’ are considered to be more ice-rich (estimates for 67P/Churyumov-Gerasimenko are about 20%;), implying lower Ir contents per impactor mass. A carbonaceous chondrite-like asteroid of the appropriate size would likely deliver ≈2.3×10^(11)g of Ir, in the center of the estimated mass range of the global Ir layer; but a comet would only deliver ∼0.1×10^(11)g, because it would be less massive. Although these conclusions are long standing, Siraj and Loeb have recently argued anew in favor of a comet over an asteroid, based on dynamical and geochemical evidence. Here we demonstrate that their arguments are based on misinterpretations of the literature, and that an asteroid is in fact still highly favored over a comet.

Steven J. Desch↗
NASA NTRS2022

The breakup of a long-period comet is not a likely match to the Chicxulub impactor

Since the discovery of Ir in the clay layer at the K-Pg boundary [1], scientists have sought to constrain the origin of the extraterrestrial impactor that triggered the end-Cretaceous mass extinction of the non-avian dinosaurs and other species. While the first proposal was for an asteroid, for a while some theories invoked a cometary impactor to explain perceived periodicities in mass extinctions. Such models have long been disfavored by the mass of Ir in the layer, inferred to be2.0−2.8×1011g. The size of Chicxulub crater leads to an estimated asteroid impactor diameter,D≈10 km. Comets typically impact at higher speeds, reducing the impactor mass for the same impact energy. Although it is increasingly recognized that a continuum exists between comets and asteroids, ’comets’ are considered to be more ice-rich (estimates for67P/ Churyumov-Gerasimenko are about 20%;), implying lower Ir contents per impactor mass. A carbonaceous chondrite-like asteroid of the appropriate size would likely deliver≈2.3×1011gof Ir, in the center of the estimated mass range of the global Ir layer; but a comet would only deliver∼0.1×1011g, because it would be less massive. Although these conclusions are long standing, Siraj & Loeb have recently argued anew in favor of a comet over an asteroid, based on dynamical and geochemical evidence. Here we demonstrate that their arguments are based on misinterpretations of the literature, and that an asteroid is in fact still highly favored over a comet.

Steven J Desch↗
NASA NTRS2019

Isotopologue Consistency of Semi-Empirically Computed InfraRed Line Lists and Further Improvement for Rare Isotopologues: CO2 and SO2 Case Studies.

The semi-empirical molecular rovibrational IR line lists, such as ExoMol, TheoReTs, and Ames, combine the experimental accuracy and theoretical power to reach better than 0.1 cm-1 accuracy for line positions and better than 80-90% agreement for line intensities. The quality of these existing semi-empirical IR lists allows further improvements of intensity and line positions for those unobserved minor isotopologues. This paper presents our new BTRHE (Best Theory + Reliable High-resolution Experiment) strategy implementation. For line intensity, the isotopologue consistency and the patterns of mass dependence in the Ames-296K SO2 and CO2 IR lists are quantitatively presented along the mass-inverse coordinates. The consistency and patterns are better than those in existing experimental data. The methodology proposed here can be used to identify inconsistencies, outliers, and mistakes in intensities, and help improve Effective Dipole Model (EDM) and molecular IR databases. We call for an experimental study on the 50006 and 60007 bands of CO2 628. For line position predictions, a simple approach combining the variational IR line lists with Effective Hamiltonian (EH) model may refine the effective rotational constants A0/B0/C0 and quartic centrifugal distortion constants of minor isotopologues. The prediction accuracy may be improved by two orders of magnitude, i.e. reaching 0-5 MHz prediction accuracy in the range of J<20-30, Ka<10-20, and 0.01-0.02 MHz accuracy for A0/B0/C0. Several important factors have been systematically investigated and discussed, e.g. convergence, uncertainties, higher order terms, fixing EH parameters, mass coordinates, etc. Amicrowave (MW) line set consisting of 644,636 strong transitions for all 30 isotopologues and corresponding refined EH(Ames) parameters are reported in the supplementary material. This approach may be easily extended to rovibrational bands, hot bands, and other molecular systems.

Xinchuan Huang↗
NASA NTRSDate not supplied

Understanding the Chemistry of PAHs in H2O Ice

Polycyclic aromatic hydrocarbons (PAHs) can be incorporated into H O ice grains and mantles found in dense molecular clouds, comets, interplanetary dust particles (IDPs), and many Solar System objects. However, laboratory infrared (IR) spectroscopic studies of PAHs in ices is still a relatively young field. Early research efforts have shown the rich chemistry of PAHs in H O to be dependent on PAH concentration, with the concentration impacting everything from IR band shifts to the photoproducts produced [1-6]. Similarly, research suggests that a potential top-down synthesis route for complex organic molecules or COMs found within solar systems is possible from PAHs in water ice [7]. In order to fully exploit the observations from the James Webb Space Telescope (JWST) more IR studies of PAHs in H O ice under relevant astrophysical conditions and planetary systems are needed. The NASA ICEE (Institute for Carbon Evolution Experiments), formerly the NASA Ames PAH IR Laboratory, has been at the forefront of this field. Starting in 2019, just before the COVID-19 shutdown, the ICEE laboratory underwent a major renovation, gearing it towards in-depth PAHs in H O ice research under relevant solar systems and interstellar conditions. The ICEE facility enables us to study the processing of PAHs in H O ice using UV photons and charged particle (electron) irradiation either singly or in combination under ultra-high vacuum and low temperature (15K). We use in-situ measurements with IR, Raman, and mass spectra by which we monitor the chemistry of PAHs in H O ice before, during and after the irradiation. This presentation will summarize the past work regarding PAHs in ices and provide an update on the latest ICEE research results in this area, outlining a roadmap for future research efforts.

Andrew Mattioda↗