Investigation of material properties of thermoplastic and thermoset polymer materials at cryogenic temperatures using molecular dynamics
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Swapnil S. Bamane↗
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Numerical studies of collapsing interstellar clouds
Numerical simulation of the structure and evolution of interstellar clouds was conducted. Steps were taken toward an integrated treatment of the dynamical, thermal, and chemical processes entering model calculations, and a detailed study was made of radiative transfer in molecular lines to allow model predictions to be tested against empirical data. It is shown that the shapes of molecular lines are sensitive to details of the cloud structure and evolutionary state and are thus useful in inferring the cloud density, temperature, chemical composition, age, and initial conditions. The calculations have successfully reproduced and explained several observed cloud properties, including abundances of complex molecular species and the apparent depletion of CO in dense cores.
Bodenheimer, Peter↗
A molecular theory of elastomer deformation and rupture.
The mechanical properties of elastomers, including rupture and its time dependence, can be semiquantitatively predicted from nine molecular parameters which are characteristic for a given species, from the initial molecular weight of a sample before cross-linking and from the effective chain concentration (which must still be determined for each vulcanizate). Only two empirical quantities are involved - the Plazek retardation function for entanglement slippage and a related constant which serves to locate this function on the time scale. The theory leads to a new method of estimating fatigue lifetimes from short-time data.
Landel, R. F.↗
Multiscale Analysis of Delamination of Carbon Fiber-Epoxy Laminates with Carbon Nanotubes
A multi-scale analysis is presented to parametrically describe the Mode I delamination of a carbon fiber/epoxy laminate. In the midplane of the laminate, carbon nanotubes are included for the purposes of selectively enhancing the fracture toughness of the laminate. To analyze carbon fiber epoxy carbon nanotube laminate, the multi-scale methodology presented here links a series of parameterizations taken at various length scales ranging from the atomistic through the micromechanical to the structural level. At the atomistic scale molecular dynamics simulations are performed in conjunction with an equivalent continuum approach to develop constitutive properties for representative volume elements of the molecular structure of components of the laminate. The molecular-level constitutive results are then used in the Mori-Tanaka micromechanics to develop bulk properties for the epoxy-carbon nanotube matrix system. In order to demonstrate a possible application of this multi-scale methodology, a double cantilever beam specimen is modeled. An existing analysis is employed which uses discrete springs to model the fiber bridging affect during delamination propagation. In the absence of empirical data or a damage mechanics model describing the effect of CNTs on fracture toughness, several tractions laws are postulated, linking CNT volume fraction to fiber bridging in a DCB specimen. Results from this demonstration are presented in terms of DCB specimen load-displacement responses.
Riddick, Jaret C.↗
Electrical conduction in polymer dielectrics
The use of polymer dielectrics with moderate resistivities could reduce or eliminate problems associated with spacecraft charging. The processes responsible for conduction and the properties of electroactive polymers are reviewed, and correlations drawn between molecular structure and electrical conductivity. These structure-property relationships led to the development of several new electroactive polymer compositions and the identification of several systems that have the requisite thermal, mechanical, environmental and electrical properties for use in spacecraft.
Cotts, D. B.↗
Latest developments in cryogenic safety
The Cryogenic Safety Manual, sponsored by the British Cryogenics Council, was published over 10 years ago. A new updated version is now available. Some general aspects of cryogenic safety are highlighted, and attention is drawn to some of the more unusual hazardous situations. An awareness of the physical properties of the cryogenic fluids being dealt with is important in directing attention to hazardous situations which may arise. Because of this, the more important properties of the cryogenic fluids are given, such as molecular weight, boiling point and freezing point. From these properties, hazardous situations can be deduced. There are hidden dangers that are not always easy to spot. Some of the unexpected hazards, most of which have led to deaths, are: asphyxiation (anoxia), frost bites and hypothermia, explosions, and combustion. The aim of this publication is to help bring about increased safety in the production and use of cryogenic products through a deeper appreciation of the scientific, technological and administrative steps which must be made if accidents, some fatal, are to be voided in the future.
Webster, T. J.↗
Combustibility Tests of 1,1,1,2-tetrafluoroethane in a Simulated Compressor Cylinder
The advantages of high-molecular-weight gas (heavy gas) as a wind-tunnel medium have been recognized for some time. The current heavy gas of choice chlorofluorocarbon-12(CFC-12) (refrigerant R12) for the Transonic Dynamics Tunnel(TDT) must be replaced because manufacture of this gas ceased in 1995. An attractive replacement is 1,1,1,2-tetrafluoroethane (refrigerant R134a). Acceptable properties of this gas include molecular weight and speed of sound. Its vapor pressure allows simplified reclamation from mixtures with air. However, it is recognized that R134a is combustible under certain conditions of temperature, pressure, and concentration. A comprehensive study was conducted to identify those conditions and the influence of various parameters on the combustibility of the gas-air mixture.
Babcock, Dale A.↗
Characterizing Transiting Planets with JWST Spectra: Simulations and Retrievals
There are now well over a thousand confirmed exoplanets, ranging from hot to cold and large to small worlds. JWST spectra will provide much more detailed information on the molecular constituents, chemical compositions, and thermal properties of the atmospheres of transiting planets than is now known. We explore this by modeling clear, cloudy,and high mean molecular weight atmospheres of typical hot Jupiter, warm Neptune, warm sub-Neptune, and cool super-Earth planets and then simulating their JWST transmission and emission spectra. These simulations were performed for several JWST instrument modes over 1 - 11 microns and incorporate realistic signal and noise components. We then performed state-of the art retrievals to determine how well temperatures and abundances (CO, CO2, H2O, NH3) will be constrained and over what pressures for these different planet types. Using these results, we appraise what instrument modes will be most useful for determining what properties of the different planets, and we assess how well we can constrain their compositions, CO ratios, and temperature profiles.
extrasolar planets↗
Characterizing Transiting Planets with JWST Spectra: Simulations and Retrievals
There are now well over a thousand confirmed exoplanets, ranging from hot to cold and large to small worlds. JWST spectra will provide much more detailed information on the molecular constituents, chemical compositions, and thermal properties of the atmospheres of transiting planets than is now known. We explore this by modeling clear, cloudy,and high mean molecular weight atmospheres of typical hot Jupiter, warm Neptune, warm sub-Neptune, and cool super-Earth planets and then simulating their JWST transmission and emission spectra. These simulations were performed for several JWST instrument modes over 1 - 11 microns and incorporate realistic signal and noise components. We then performed state-of the art retrievals to determine how well temperatures and abundances (CO, CO2, H2O, NH3) will be constrained and over what pressures for these different planet types. Using these results, we appraise what instrument modes will be most useful for determining what properties of the different planets, and we assess how well we can constrain their compositions, CO ratios, and temperature profiles.
James Webb Space Telescope↗
The FCRAO extragalactic CO survey: Global properties of galaxies
Since stars form in molecular clouds, a critical element in studies of galaxy evolution is knowledge of the molecular content of a large sample of galaxies. To this end, researchers undertook a survey of CO emission from galaxies using the Fire College Radio Astronomy Observatory (FCRAO) 14-m millimeter telescope at 115 GHz. The aim was to better understand the differences found among and within galaxies with regard to the efficiency of star and cloud formation. The galaxies observed as part of the FCRAO Extragalactic CO Survey were selected on the basis of their optical or infrared properties. The galaxies observed thus far are (1) brighter than B sub T (sub o)=12.5 in the blue, or (2) brighter than 20 Jy at 100 microns. From major axis CO observations at 45 seconds resolution and spacing in over 200 galaxies, researchers determined the CO radial distributions, and derived global CO fluxes (cf. Kenney and Young 1988); H2 masses were derived using the conversion factor N(H2)/I sub CO=2.8 times 10 to the 20th power cm(-2)/K km s(-1)) (Bloemen et al. 1986). Here, researchers concentrate on the global galaxy properties within the sample. Neutral hydrogen (HI) masses for the sample galaxies were taken from Huchtmeier et al. (1983), blue luminosities and morphological types were taken from RC2. IR luminosities, colors, dust temperatures and dust masses were determined from coadded Infrared Astronomy Satellite (IRAS) data (Young et al. 1989). They have chosen to first compare absolute luminosities and masses in order to determine the slope and scatter in each correlation; next they investigate luminosity independent ratios in order to intercompare large and small galaxies.
Young, J. S.↗
Computational Chemistry of Adhesive Bonds
This investigation is intended to determine the electrical mechanical, and chemical properties of adhesive bonds at the molecular level. The initial determinations will be followed by investigations of the effects of environmental effects on the chemistry and properties of the bond layer.
Phillips, Donald H.↗
Formulation/cure technology for ultrahigh molecular weight silphenylene-siloxane polymers
Molecular weights above one million were achieved for methylvinylsilphenylene-siloxane terpolymers using a two-stage polymerization technique which was successfully scaled up to 200 grams. The resulting polymer was vulcanized by two different formulations and compared to an identically formulated commercial methylvinyl silicone on the basis of ultimate strength, Young's modulus, percent elongation at failure, and tear strength. Relative thermal/oxidative stabilities of the elastomers were assessed by gradient and isothermal thermogravimetric analyses performed in both air and nitrogen. The experimental elastomer exhibited enhanced thermal/oxidative stability and possed equivalent or superior mechanical properties. The effect of variations in prepolymer molecular weight on mechanical properties was also investigated.
Hundley, N. H.↗
IRAS Colors of the Pleiades
We present large scale images of the infrared emission of the region around the Pleiades using the ISSA data product from the IRAS mission. Residual Zodiacal background and a discontinuity in the image due to the scanning strategy of the satellite necessitated special background subtraction methods. The 60/100 color image clearly shows the heating of the ambient interstellar medium by the cluster. The 12/100 and 25/100 images peak on the cluster as expected for exposure of small dust grains to an enhanced UV radiation field; however, the 25/100 color declines to below the average interstellar value at the periphery of the cluster. Potential causes of the color deficit are discussed. A new method of identifying dense molecular material through infrared emission properties is presented. The difference between the 100 micron flux density and the 60 micron flux density scaled by the average interstellar 60/100 color ratio (Delta I(sub 100) is a sensitive diagnostic of material with embedded heating sources (Delta I(sub 100) less than 0) and cold, dense cores (Delta I(sub 100) greater than 0). The dense cores of the Taurus cloud complex as well as Lynds 1457 are clearly identified by this method, while the IR bright but diffuse Pleiades molecular cloud is virtually indistinguishable from the nearby infrared cirrus.
Carey, Sean J.↗
Development and Application of Tools to Characterize the Oxidative Degradation of AP/HTPB/Al Propellants in a Propellant Reliability Study
The oxidative thermal aging of a crosslinked hydroxyl-terminated polybutadiene (HTPB)/isophorone diisocyanate (IPDI) polyurethane rubber was studied at temperatures between 25 C and 125 C. Changes in tensile elongation, mechanical hardening, polymer network properties, density, O2 permeation, and molecular chain dynamics were investigated as a function of age. The techniques used include solvent swelling, detailed modulus profiling, and NMR relaxation measurements. The Arrhenius methodology, which normally assumes a linear extrapolation of high temperature aging data, is critically evaluated by using extensive data superposition and highly sensitive oxygen consumption measurements. Significant curvature in the Arrhenius diagram of these oxidation rates is observed to be similar to previous results found for other rubber materials that have been evaluated by this technique. Preliminary gel/network properties suggest that crosslinking is the dominant process at higher temperatures. The effect on the oxidation rate of the binder when other constituents found in propellants are present, such as ammonium perchlorate, plasticizer and aluminum powder, is presented.
Celina, Mathew↗
The RNA World and its origins
The theory of the "RNA World" states that the first molecular systems to display the properties of self-replication and evolution were RNA molecules. The origin of life not only depended crucially upon this event, but RNA molecules can even be viewed as the first "living" things. In recent years this theory has gained ascendancy over competing ideas and is now largely accepted by biologists as the most satisfactory explanation for the origin of life. The reasons for this development will be reviewed and the problem of the origin of the first RNA molecules will be discussed.
RNA/analysis/genetics/physiology↗
Surface lubrication of magnetic tape
Friction minimization between magnetic media (tape, cards, drums, etc.) and magnetic transducer (heads, etc.) is a key requirement in recording systems. Results are presented for an investigation intended to eliminate previously encountered shortcomings of friction-reducing treatments by a deposition of an inert liquid film on a fully manufactured (cured) magnetic medium. The film contains no particles, represents a compound characterized by good lubricating and thermal properties, is inert with respect to the normal formulation constituents, and has low surface tension and vapor pressure characteristics. The deposited film need only be molecularly thin to impart adequate lubricating properties to the tape. The discussion covers the characteristics of the surface lubricant, method of application, and surface coated magnetic media test results. Greater than 5 million passes of the 3M 900 tape on a loop tester are achieved with no apparent effect on the tape and with head wear decreased by as much as a factor of ten
Wright, C. D.↗
Interstellar molecular hydrogen
Recent progress in the detection of H2 in the interstellar medium is reviewed. The hydrogen molecule is discussed in terms of properties, and collisional excitation and dissociation rates. Molecular hydrogen formation and cooling and heating by H2 are also discussed. Ultraviolet studies provided information for the study of the formation-destruction equilibrium of H2, the kinetic temperature of the cloud, the hydrogen particle density, and the ultraviolet radiation field. Infrared observations in Orion and the planetary nebula NGC 7027 reveal two detections of vibrationally excited H2. In addition, thermal and nonthermal excitation mechanisms are discussed. Finally, it is noted that increased ultraviolet sensitivity is necessary for thorough H2 studies.
Shull, J. M.↗
Diffusion and infrared properties of molecules in ice mantles
Within dense molecular clouds the formation of frozen icy mantles on interstellar dust grains is thought to be the result of various growth conditions. The molecules, which make up the ice mantles are probably completely mixed. To study the physical properties of such ice mixtures the experiments were performed on the evaporation processes and on the spectroscopic properties of CO, CO2, and CH4 in water rich ices. The decrease in concentration of volatile molecules in ice samples deposited at 10 K and subsequently heated is found to occur essentially in two steps. The first one, corresponding to an evaporation of part of the volatile molecules, starts at about 25 K for CO, 32 K for CH4, and 70 K for CO2. During the crystallization of H2O ice at temperatures greater than 120 K a second evaporation occurs leading to the complete disappearance of the volatile molecules in the solid phase. The main astrophysical implications of the diffusion and spectroscopic behaviors are presented. The possible effects of a heating source on the fraction of volatile molecules, such as CO trapped in grain mantles, are discussed.
Schmitt, Bernard↗