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At least 1,531 records · Page 85
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

A family of entangled coordination polymers constructed from a flexible V-shaped long bicarboxylic acid and auxiliary N-donor ligands: Luminescent sensing

Eight Zn(II)-based coordination polymers, namely, [Zn{sub 2}L{sub 2}(2,2’-bipy)]{sub n}·nH{sub 2}O (1), [Zn{sub 2}L{sub 2}(phen)]{sub n}·nH{sub 2}O (2), [ZnL(phen)(H{sub 2}O)]{sub n} (3), [Zn{sub 3}L{sub 3}(4,4’-bipy)]{sub n} (4), [Zn{sub 2}L{sub 2}(4,4’-bipy){sub 2}]{sub n} [Zn{sub 2}L{sub 2}(H{sub 2}O){sub 2}]{sub n}·2nH{sub 2}O (5), [Zn{sub 4}L{sub 4}(bpp){sub 2}]{sub n} (6), [ZnL(bbi){sub 0.5}]{sub n} (7), [ZnL(bpz)]{sub n} (8) (H{sub 2}L=4,4’-([1,2-phenylenebis-(methylene)]bis(oxy))dibenzoic acid, 2,2’-bipy =2,2’-bipyridine, phen =1,10-phenanthroline, 4,4’-bpy=4,4’-bipyridine, bpp =1,3-bis(4-pyridyl)propane, bbi=1,4-bis(imidazol-1-yl)butane, bpz=3,3′,5,5′-tetramethyl-4,4′-bipyrazole), have been hydrothermally synthesized and structurally characterized. 1–8 display various coordination motifs with different entangled forms and conformations due to the effect of the assistant N-donor ligands. The photoluminescent properties of compounds 1–8 in solid state were studied. Interestingly, 3 exhibits highly efficient luminescent sensing for Cu{sup 2+} cations and CrO{sub 4}{sup 2-} anions, as well as detection ability for the different organic solvents and nitro explosives. These results indicated that it could be utilized as a multi-responsive luminescent sensor. Furthermore, compound 3 also shows good chemical resistance to both acidity and alkalinity solutions with pH ranging from 2 to 13. Thus, multi-photofunctionality and fluorescent response to pH have been combined in the 3, which is the first example in the Zn-based hybrid materials. - Graphical abstract: Eight new Zn(II)-based coordination polymers constructed from a flexible V-shaped long bicarboxylic acid and different N-donor ligands have been hydrothermally synthesized through fixing the metal salts and the solvent systems. The photoluminescent properties of complexes 1−8 in solid state were studied. Interestingly, 3 exhibits highly efficient luminescent sensing for Cu{sup 2+} cations and CrO{sub 4}{sup 2-} anions, as well as detection ability for the different organic solvents and nitro explosives, in which indicates it could be utilized as a multi-responsive luminescent sensor. Furthermore, compound 3 also shows good chemical resistance to both acidity and alkalinity solutions with pH ranging from 2 to 13. Thus, multiphotofunctionality and fluorescent response to pH have been combined in the 3, which is the first example in the Zn-based hybrid materials.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1987

Explosive volcanic deposits on Mars: Preliminary investigations

Two investigations were undertaken to examine possible large scale explosive volcanic deposits on Mars. The first includes an analysis of Viking Infrared Thermal Mapper (IRTM) data covering the vast deposits in the Amazonis, Memnonia, and Aeolis regions. These postulated ignimbrites have been previously mapped, and at least five high resolution nighttime IRTM data tracks cross the deposits. Preliminary analysis of the data covering Amazonis Planitia show that local features have anomalous thermal inertias but the ignimbrites as a whole do not consistently have significantly different thermal inertias from their surroundings. Preliminary photogeologic and IRTM studies of the large and small highland paterae have also begun. The purpose of IRTM studies of postulated Martian explosive volcanic deposits is to determine the physical properties of the proposed ignimbrites. If volcanic deposits are exposed at the surface, high thermal inertias, as are observed for Apollinaris Patera, should be present.

Crown, D. A.↗
DOE OSTI2018

A robust two-dimensional zirconium-based luminescent coordination polymer built on a V-shaped dicarboxylate ligand for vapor phase sensing of volatile organic compounds

Here we report herein a new two-dimensional zirconium-based luminescent coordination polymer Zr 6 (sdba) 4 (μ 3 -O) 4 (μ 3 - OH) 4 (HCOO) 2 (OH) 2 (H 2 O) 2 (1) [sdba = 4,4'-sulfonyldibenzoate] exhibiting selective fluorescence responses towards a variety of volatile organic compounds upon exposure in the vapor phase. Having a unique two-dimensional signal response towards aromatic molecules, including but not limited to nitroaromatic explosives, it is capable of identification of a diverse set of analytes. In addition, compound 1 shows a remarkably high sensitivity toward acetone vapors.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Kubernetes for the Deep Underground Neutrino Experiment Data Acquisition

The Deep Underground Neutrino Experiment (DUNE) is a next-generation long-baseline neutrino experiment based in the USA which is expected to start taking data in 2029. DUNE aims to precisely measure neutrino oscillation parameters by detecting neutrinos from the LBNF beamline (Fermilab) at the Far Detector, 1,300 kilometres away, in South Dakota at the Sanford Underground Research Facility. The Far Detector will consist of four cryogenic Liquid Argon Time Projection Chamber detectors of 17 kT, each producing more than 1 TB/sec of data. The main requirements for the data acquisition system are the ability to run continuously for extended periods of time, with a 99% up-time requirement, and the functionality to record both beam neutrinos and low energy neutrinos from the explosion of a neighbouring supernova, should one occur during the lifetime of the experiment. The key challenges are the high data rates that the detectors generate and the deep underground environment, which places constraints on power and space. To overcome these challenges, DUNE plans to use a highly optimised C++ software suite and a server farm of about 110 nodes continuously running about two hundred multicore processes located close to the detector, 1.5 kilometres underground. Thirty nodes will be at the surface and will run around two hundred processes simultaneously. DUNE is studying the use of the Kubernetes framework to manage containerised workloads and take advantage of its resource definitions and high up-time services to run the DAQ system. Progress in deploying these systems at the CERN neutrino platform on the prototype DUNE experiments is reported.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2013

Trigger - and heat-transfer times measured during experimental molten-fuel-interactions

A modified setup featuring high speed high resolution data and video recording was developed to obtain detailed information on trigger and heat transfer times during explosive molten fuel-coolant-interaction (MFCI). MFCI occurs predominantly in configurations where water is entrapped by hot melt. The setup was modified to allow direct observation of the trigger and explosion onset. In addition the influences of experimental control and data acquisition can now be more clearly distinguished from the pure phenomena. More precise experimental studies will facilitate the description of MFCI thermodynamics.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2015

High stored-energy breakdown tests on electrodes made of stainless steel, copper, titanium and molybdenum

IRFM have conducted resilience tests on electrodes made of Cu, stainless steel 304L, Ti and Mo against breakdowns up to 170 kV and 300 J. The tests of the 10×10 cm{sup 2} electrodes have been performed at an electrode distance d=11 mm under vacuum (P∼5×10{sup −6} mbar). No great difference in voltage holding between the materials could be identified; all materials could reach a voltage holding between 140 and 170 kV over the 11 mm gap, i.e. results scatter within a ±10% band. After exposure to ∼10000 seconds of high-voltage (HV) on-time, having accumulated ∼1000 breakdowns, the electrodes were inspected. The anodes were covered with large and small craters. The rugosity of the anodes had increased substantially, that of the cathodes to a lesser extent. The molybdenum electrodes are least affected, but this does not show in their voltage holding capability. It is hypothesized that penetrating high-energy electrons from the breakdown project heat below the surface of the anode and cause a micro-explosion of material when melting point is exceeded. Polished electrodes have also been tested. The polishing results in a substantially reduced breakdown rate in the beginning, but after having suffered a relatively small number (∼100) of breakdowns, the polished electrodes behaved the same as the unpolished ones.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

Nonclassical “Explosive” nucleation in Pb/Si(111) at low temperatures

In this study, the onset of nucleation is defined in terms of a critical cluster of the condensed phase, which forms from the gradual aggregation of randomly diffusing adatoms. Experiments in Pb/Si(111) at low temperature have discovered a dramatically different type of nucleation, with perfect crystalline islands emerging “explosively” out of the compressed wetting layer after a critical coverage Θ c =1.22 ML is reached. The unexpectedly high island growth rates, the directional correlations in the growth of neighboring islands and the persistence in time of where mass is added in individual islands, suggest that nucleation is a result of the highly coherent motion of the wetting layer, over mesoscopic distances.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2019

Influence of Langasite Crystal Orientation on Hydrogen Gas Detection up to 400°C

Hydrogen gas sensors are of great importance due to the explosive nature and volatility of H 2 at concentrations above 4%. Also important is the capability of operation at high temperatures in harsh industrial environments, aerospace, automotive, and power generation applications. Surface Acoustic Wave (SAW) technology offers many desirable properties for sensor fabrication, such as the capability of wireless and battery free operation, mass-production, small size and weight. Piezoelectric substrates or thin films, such as langasite and aluminum nitrate, exist that allow SAW devices to operate at high temperatures. Langasite SAW-based devices have been previously demonstrated as temperature, strain and gas sensors. For high temperature SAW-based gas sensors, sensitive films capable to react selectively with the target species are normally used. This work presents the detection of hydrogen gas at high-temperature (up to 470 C) using SAW resonators on the commercially available LGS plane described by Euler angles {0°, 138.5°,Ψ}. The Pt-Al 2 O 3 composite thin film is used as both the electrode and sensitive layer. Devices fabricated along different crystal orientations on the same wafer revealed different sensitivities to H 2 , which were also measured as a function of temperature up to 470 C. These different sensitivities to H 2 open the possibility of using different orientations of this commercially available LGS crystal cut to fabricate sensors capable of operating as a network, and detecting different measurands at high-temperature, including hydrogen gas.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Preliminary EDS Liquid Sample Adapter Design Assurance Testing

A new liquid sample adapter design for the Explosive Destruction Systems has been developed. The design features a semi-transparent fluoropolymer tube coupled to the vessel high pressure sample valve with a closing quick connect fitting. The sample tubes are the pressure-limiting component. The tubes were hydrostatically tested to establish failure characteristics and pressure limits at ambient and operational temperatures. A group of tubes from two manufacturing lots were tested to determine the consistency of the commercial part. An upper pressure limit was determined for typical operations.

42 ENGINEERING↗
NASA NTRS1979

The violent interstellar medium

Observational evidence for high-velocity and high-temperature interstellar gas is reviewed. The physical processes that characterize this gas are described, including the ionization and emissivity of coronal gas, the behavior and appearance of high-velocity shocks, and interfaces between coronal gas and cooler interstellar gas. Hydrodynamical models for the action of supernova explosions and stellar winds on the interstellar medium are examined, and recent attempts to synthesize all the processes considered into a global model for the interstellar medium are discussed.

Mccray, R.↗
NASA NTRS1991

Applying NASA's explosive seam welding

The status of an explosive seam welding process, which was developed and evaluated for a wide range of metal joining opportunities, is summarized. The process employs very small quantities of explosive in a ribbon configuration to accelerate a long-length, narrow area of sheet stock into a high-velocity, angular impact against a second sheet. At impact, the oxide films of both surface are broken up and ejected by the closing angle to allow atoms to bond through the sharing of valence electrons. This cold-working process produces joints having parent metal properties, allowing a variety of joints to be fabricated that achieve full strength of the metals employed. Successful joining was accomplished in all aluminum alloys, a wide variety of iron and steel alloys, copper, brass, titanium, tantalum, zirconium, niobium, telerium, and columbium. Safety issues were addressed and are as manageable as many currently accepted joining processes.

Bement, Laurence J.↗
NASA NTRS2007

SN 1987A after 18 Years: Mid-Infrared GEMINI and SPITZER Observations of the Remnant

We present high resolution 11.7 and 18.3 micron mid-IR images of SN 1987A obtained on day 6526 since the explosion with the Thermal-Region Camera and Spectrograph (T-ReCS) attached to the Gemini South 8m telescope. The 11.7 micron flux has increased significantly since our last observations on day 6067. The images clearly show that all the emission arises from the equatorial ring (ER). Nearly contemporaneous spectra obtained on day 6184 with the MIPS at 24 micron, on day 6130 with the IRAC in 3.6- 8 micron region, and on day 6190 with the IRS in the 12-37 micron instruments on board the Spitzer Space Telescope's show that the emission consists of thermal emission from silicate dust that condensed out in the red giant wind of the progenitor star. The dust temperature is 1662(sup +18) (sub -12) K, and the emitting dust mass is (2.6(sup +2.0 (sub -1.4)) x 10 (exp -6) M(solar). Lines of [Ne II] 12.82 micron and [Ne III] 15.56 pm are clearly present in the Spitzer spectrum, as well as a weak [Si II] 3 34.8 micron line. We also detect two lines near 26 micron which we tentatively ascribe to [Fe II] 25.99 pm and [0 IV] 25.91 micron. Comparison of the mid-IR Gemini 11.7 micron image with X-ray images obtained by Chandra, UV-optical images obtained by HST, and radio synchrotron images obtained by the ATCA show generally good correlation of the images across all wavelengths. Because of the limited resolution of the mid-IR images we cannot uniquely determine the location. or heating mechanism of the dust giving rise to the emission. The dust could be collisionally heated by the X-ray emitting plasma, providing a unique diagnostic of plasma conditions. Alternatively, the dust could be radiatively heated in the dense UV-optical knots that are overrun by the advancing supernova blast wave. In either case the dust-to-gas mass ratio in the circumstellar medium around the supernova is significantly lower than that in the general interstellar medium of the LMC, suggesting either a low condensation efficiency in the wind of the progenitor star, or the efficient destruction of the dust by the SN blast wave. Overall, we are witnessing the interaction of the SN blast wave with its surrounding medium, creating an environment that is rapidly evolving at all wavelengths. Continuous multiwavelength observations of SN 1987A such as these provide unique snapshots of the very early evolution of supernova remnants.

Bouchet, Patrice↗
NASA NTRS2008

A Model for Solar Polar Jets

We propose a model for the jetting activity that is commonly observed in the Sun's corona, especially in the open-field regions of polar coronal holes. Magnetic reconnection is the process driving the jets and a relevant magnetic configuration is the well-known null point and fan separatrix topology. The primary challenge in explaining the observations is that reconnection must occur in a short-duration energetic burst rather than quasi-continuously as is implied by the observations of long-lived structures in coronal holes, such as polar plumes, for example. The key idea underlying our model for jets is that reconnection is forbidden for an axisymmetric null-point topology. Consequently, by imposing a twisting motion that maintains the axisymmetry, magnetic stress can be built up to large levels until an ideal instability breaks the symmetry and leads to an explosive release of energy via reconnection. Using 3D MHD simulations we demonstrate that this mechanism does produce jets with high speed and mass, driven by nonlinear Alfven waves. We discuss the implications of our results for observations of the solar corona.

Pariat, E.↗
NASA NTRS2010

Si Isotopes of Brownleeite

Brownleeite is a manganese silicide, ideally stoichiometric MnSi, not previously observed in nature until its discovery within an interplanetary dust particle (IDP) that likely originated from a comet [1]. Three discrete brownleeite grains in the IDP L2055 I3 (4 microns in size, hereafter IDP I3) were identified with maximum dimensions of 100, 250 and 600 nm and fully analyzed using scanning-transmission electron microscopy (STEM) [1]. One of the grains (100 nm in size) was poikilitically enclosed by low-Fe, Mn-enriched (LIME) olivine. LIME olivine is epitaxial to the brownleeite with the brownleeite (200) parallel to the olivine c* [1]. LIME olivine is an enigmatic phase first reported from chondritic porous IDPs and some unequilibrated ordinary chondrites [ 2], that is commonly observed in chondritic-porous IDPs. Recently, LIME olivine has been also found in comet Wild-2 (Stardust) samples [3], indicating that LIME olivine is a common mineral component of comets. LIME olivine has been proposed to form as a high temperature condensate in the protosolar nebula [2]. Brownleeite grains also likely formed as high-temperature condensates either in the early Solar System or in the outflow of an evolved star or supernova explosion [1]. The isotopic composition of the brownleeite grains may strongly constrain their ultimate source. To test this hypothesis, we performed isotopic analyses of the brownleeite and the associated LIME olivine, using the NASA/JSC NanoSIMS 50L ion microprobe.

Nakamura-Messenger, K.↗
DOE OSTI2016

High-performance epistasis detection in quantitative trait GWAS

epiSNP is a program for identifying pairwise single nucleotide polymorphism (SNP) interactions (epistasis) in quantitative-trait genome-wide association studies (GWAS). A parallel MPI version (EPISNPmpi) was created in 2008 to address this computationally expensive analysis on large data sets with many quantitative traits and SNP markers. However, the falling cost of genotyping has led to an explosion of large-scale GWAS data sets that challenge EPISNPmpi’s ability to compute results in a reasonable amount of time. Therefore, we optimized epiSNP for modern multi-core and highly parallel many-core processors to efficiently handle these large data sets. This paper describes the serial optimizations, dynamic load balancing using MPI-3 RMA operations, and shared-memory parallelization with OpenMP to further enhance load balancing and allow execution on the Intel Xeon Phi coprocessor (MIC). For a large GWAS data set, our optimizations provided a 38.43× speedup over EPISNPmpi on 126 nodes using 2 MICs on TACC’s Stampede Supercomputer. We also describe a Coarray Fortran (CAF) version that demonstrates the suitability of PGAS languages for problems with this computational pattern. We show that the Coarray version performs competitively with the MPI version on the NERSC Edison Cray XC30 supercomputer. Finally, the performance benefits of hyper-threading for this application on Edison (average 1.35× speedup) are demonstrated.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2022

An Investigation into the Surface Skidding Response of PBX 9501 and PBX 9502

While polymer-bonded explosives, PBX, have reduced sensitivity to ignition from mechanical shock or heating compared to conventional explosives, the investigation of the mechanical ignition mechanisms for PBX remains vital to assessing the safety during machining and general handling. Under frictional heating, hot spot generation due to high melting point contaminants in the interface is a suspected source for increased probability of detonation. Here, to investigate such frictional heating, samples of PBX 9501 and PBX 9502 were impacted and skidded against a tangentially moving target and thermally imaged. Temporally resolved temperature and forces were simultaneously measured with and without 300 µm silica grit at the frictional interface. A trend of increasing temperature was observed as the speed and tangential force on the sample increased. Grit particles in the frictional interface were found to act as frictional heat concentration spots owing to the grit's protrusion from the surface and lesser susceptibility to melting compared to the PBX. The coefficient of friction between PBX 9501 and the skidding surface was observed to be largely constant for forces and speeds at the lower end of the test range. In contrast, at high tangential speeds, the coefficient was found to be significantly lower.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Topographic controls on a phreatomagmatic maar-diatreme eruption: field and numerical results from the Holocene Dotsero volcano (Colorado, USA)

We analyzed the eruptive products of Holocene Dotsero volcano (Colorado, USA; ~4.15 ka), which recorded evidence of a progression from effusive magmatic activity through explosive phreatomagmatic maar-forming activity to a final explosive magmatic phase. The nature of the deposits suggests that the irregular and mountainous pre-eruptive topography strongly influenced the formation of directed pyroclastic density currents (PDCs) during the phreatomagmatic phase, where the topographically high northern crater rim acted as a barrier and promoted transport to the south. Furthermore, the crater shape strongly controlled the grain size of the final deposits, providing further evidence that deposit grain size can be a misleading proxy for fragmentation or explosion intensity. We test these hypotheses, as gleaned from fieldwork, by implementing a multiphase numerical model to simulate discrete explosions and their resulting PDCs at maar-diatreme volcanoes. We confirm that a crater shape where one rim is higher than the other promotes multiple pulses of particle transport in the direction of the lower rim. The initial PDCs contain both coarse and fine particles, whereas PDCs generated by later pulses contain, predominately, finer particles. This mechanism provides an alternative explanation to the formation of lapilli tuff/tuff couplets often found at maar-diatreme tephra rings (including Dotsero volcano). Additional modeling shows how the crater depth can control grain size of the resulting PDC deposits. In the case of a deep crater and a relatively weak explosion, it is possible that only the fine particles escape following collapse of the eruptive column, resulting in a fine-grained deposit. This work allows us to improve models developed to describe emplacement of PDCs for different crater geometries and informs on the dynamics of maar-diatreme eruptions, but also highlights the limitations of our knowledge of key parameters, especially those related to the processes of magma-water interaction and syn-eruptive hydrogeology, during such events.

58 GEOSCIENCES↗
DOE OSTI2020

On the character of turbulent-like flows in self-consistent models of core-collapse supernovae

Neutrino-driven convection plays a crucial role in the development of core-collapse supernova (CCSN) explosions. However, the complex mechanism that triggers the shock revival and the subsequent explosion has remained inscrutable for many decades. Multidimensional simulations suggest that the growth of fluid instabilities, especially development of convection, will determine the morphology of the explosion. We have performed 3D simulations using spherical-polar coordinates covering a reduced angular extent (90° computational domain), and with angular resolutions of 2°, 1°, 1/2°, and 1/4°, to study the development of turbulent-like flows in core-collapse supernova explosions on a time scale of order 100 ms. We have employed the multi-physics Chimera code that includes detailed nuclear physics and spectral neutrino transport. Coarse resolution models do not develop an inertial range, presumably due to the bottleneck effect, such that the energy is prevented from cascading down to small scales and tends to accumulate at large scales. High-resolution models instead, start to recover the k −5/3 scaling of Kolmogorov's theory. Stochasticity and few simulation samples limit our ability to predict the development of explosions. Over the simulated time period, our models show no clear trend in improving (or diminishing) conditions for explosion as the angular resolution is increased. However, we find that disordered flow provides an effective pressure, as characterized by the Reynolds stress, behind the shock. This contribution, ~40%–50% of the thermal pressure, aids shock revival and thus the development of the explosion. Finally, we show that the kinetic energy power spectrum of reduced angular extent and full 4π models are consistent, thus indicating that a 90° computational domain is an adequate configuration to study the character of turbulence in CCSNe.

Casanova Bustamante, Jordi↗