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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 253 records · Page 14
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

THE CONTRIBUTION OF FERMI -2LAC BLAZARS TO DIFFUSE TEV–PEV NEUTRINO FLUX

The recent discovery of a diffuse cosmic neutrino flux extending up to PeV energies raises the question of which astrophysical sources generate this signal. Blazars are one class of extragalactic sources which may produce such high-energy neutrinos. We present a likelihood analysis searching for cumulative neutrino emission from blazars in the 2nd Fermi -LAT AGN catalog (2LAC) using IceCube neutrino data set 2009-12, which was optimized for the detection of individual sources. In contrast to those in previous searches with IceCube, the populations investigated contain up to hundreds of sources, the largest one being the entire blazar sample in the 2LAC catalog. No significant excess is observed, and upper limits for the cumulative flux from these populations are obtained. These constrain the maximum contribution of 2LAC blazars to the observed astrophysical neutrino flux to 27% or less between around 10 TeV and 2 PeV, assuming the equipartition of flavors on Earth and a single power-law spectrum with a spectral index of −2.5. We can still exclude the fact that 2LAC blazars (and their subpopulations) emit more than 50% of the observed neutrinos up to a spectral index as hard as −2.2 in the same energy range. Our result takes into account the fact that the neutrino source count distribution is unknown, and it does not assume strict proportionality of the neutrino flux to the measured 2LAC γ -ray signal for each source. Additionally, we constrain recent models for neutrino emission by blazars.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS2016

Ion-Scale Secondary Flux Ropes Generated by Magnetopause Reconnection as Resolved by MMS

New Magnetospheric Multiscale (MMS) observations of small-scale (approx. 7 ion inertial length radius) flux transfer events (FTEs) at the dayside magnetopause are reported. The 1O km MMS tetrahedron size enables their structure and properties to be calculated using a variety of multispacecraft techniques, allowing them to be identified as flux ropes, whose flux content is small (approx. 22 kWb).The current density, calculated using plasma and magnetic field measurements independently, is found to be filamentary. lntercomparison of the plasma moments with electric and magnetic field measurements reveals structured non-frozen-in ion behavior. The data are further compared with a particle-in-cell simulation. It is concluded that these small-scale flux ropes, which are not seen to be growing, represent a distinct class of FTE which is generated on the magnetopause by secondary reconnection.

Eastwood, J. P.↗
DOE OSTI2020

A2Cloud‐RF : A random forest based statistical framework to guide resource selection for high‐performance scientific computing on the cloud

Summary This article proposes a random‐forest based A2Cloud framework to match scientific applications with Cloud providers and their instances for high performance. The framework leverages four engines for this task: PERF engine, Cloud trace engine, A2Cloud‐ext engine, and the random forest classifier (RFC) engine. The PERF engine profiles the application to obtain performance characteristics, including the number of single‐precision (SP) floating‐point operations (FLOPs), double‐precision (DP) FLOPs, x87 operations, memory accesses, and disk accesses. The Cloud trace engine obtains the corresponding performance characteristics of the selected Cloud instances including: SP floating point operations per second (FLOPS), DP FLOPS, x87 operations per second, memory bandwidth, and disk bandwidth. The A2Cloud‐ext engine uses the application and Cloud instance characteristics to generate objective scores that represent the application‐to‐Cloud match. The RFC engine uses these objective scores to generate two types of random forests to assist users with rapid analysis: application‐specific random forests (ARF) and application‐class based random forests. The ARF consider only the input application's characteristics to generate a random forest and provide numerical ratings to the selected Cloud instances. To generate the application‐class based random forests, the RFC engine downloads the application profiles and scores of previously tested applications that perform similar to the input application. Using these data, the RFC engine creates a random forest for instance recommendation. We exhaustively test this framework using eight real‐world applications across 12 instances from different Cloud providers. Our tests show significant statistical agreement between the instance ratings given by the framework and the ratings obtained via actual Cloud executions.

Samuel, David↗
DOE OSTI2020

Experimental study of hot electron generation in shock ignition relevant high-intensity regime with large scale hot plasmas

In the shock ignition (SI) laser fusion scheme, hot electrons generated by the laser spike pulse can either preheat the fuel or strengthen the ignition shock, depending on the hot electron characteristics. We conducted a planar target experiment on the OMEGA-EP laser facility and characterized the temperature and total energy of hot electrons generated from a kilojoule-class 100-ps infrared (IR) or a 1-ns ultraviolet (UV) laser interacting with a large (L n ~330-450 μm) and hot (T e ~1-2 keV) coronal plasma at the SI-relevant intensities (~10 16 W/cm 2 ). The IR laser converts ~2.5% energy into hot electrons with T hot ~ 60–90 keV, while the UV laser couples 0.8% ± 0.7% energy into T hot =27 ± 9 keV hot electrons. The IR-produced hot electrons yield five times higher Cu Kα emission than the UV case, confirming the higher electron conversion efficiency with the IR laser. The low energy conversion from the UV laser to hot electrons may be due to the refraction of the off-normal incident laser in the large coronal plasma. These findings are the first comparisons of hot electron generation between the IR and UV pulses at kilojoule scales in SI-relevant large-scale plasmas. The findings may expand the SI design space to include IR lasers as the possible spike lasers.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2018

Schottky Junction Vertical Channel GaN Static Induction Transistor with a Sub‐Micrometer Fin Width

Abstract GaN‐based vertical transistors have demonstrated its excellent properties for high‐power and high‐frequency electronic devices. This work introduces a GaN‐based static induction transistor (SIT) which is another form of vertical GaN transistors without requiring any p ‐type GaN and gate dielectrics for its operation. Processing strategy to generate the GaN SIT with a sub‐micrometer fin width involves photoresist (PR)‐assisted planarization with an understanding of dry etch parameters for the planar PR surface. The efficacy of this process is demonstrated by the device's triode‐like output characteristics with high current density (0.65 kA cm −2 ) and low ON resistance (1.48 mΩ cm 2 ) at 1 V of drain voltage. In addition, the electrical properties such as current density and modulation are examined depending on the fin width of GaN SIT. The result reveals that the size reduction in the GaN SIT utilizing the sub‐micrometer fin as a channel could increase the current modulation, but it could decrease the current density because of the raised potential minima due to the depletion region overlap. It is believed that the GaN SIT demonstrating high blocking voltage and low ON resistance would present a very promising class of transistor for next‐generation high‐power and high‐frequency electronics.

Chun, Jaeyi↗
DOE OSTI2014

Evidence That the [beta] Subunit of Chlamydia trachomatis Ribonucleotide Reductase Is Active with the Manganese Ion of Its Manganese(IV)/Iron(III) Cofactor in Site 1

The reaction of a class I ribonucleotide reductase (RNR) begins when a cofactor in the {beta} subunit oxidizes a cysteine residue {approx}35 {angstrom} away in the {alpha} subunit, generating a thiyl radical. In the class Ic enzyme from Chlamydia trachomatis (Ct), the cysteine oxidant is the Mn{sup IV} ion of a Mn{sup IV}/Fe{sup III} cluster, which assembles in a reaction between O{sub 2} and the Mn{sup II}/Fe{sup II} complex of {beta}. The heterodinuclear nature of the cofactor raises the question of which site, 1 or 2, contains the Mn{sup IV} ion. Because site 1 is closer to the conserved location of the cysteine-oxidizing tyrosyl radical of class Ia and Ib RNRs, we suggested that the Mn{sup IV} ion most likely resides in this site (i.e., {sup 1}Mn{sup IV}/{sup 2}Fe{sup III}), but a subsequent computational study favored its occupation of site 2 ({sup 1}Fe{sup III}/{sup 2}Mn{sup IV}). In this work, we have sought to resolve the location of the Mn{sup IV} ion in Ct RNR-{beta} by correlating X-ray crystallographic anomalous scattering intensities with catalytic activity for samples of the protein reconstituted in vitro by two different procedures. In samples containing primarily Mn{sup IV}/Fe{sup III} clusters, Mn preferentially occupies site 1, but some anomalous scattering from site 2 is observed, implying that both {sup 1}Mn{sup II}/{sup 2}Fe{sup II} and {sup 1}Fe{sup II}/{sup 2}Mn{sup II} complexes are competent to react with O{sub 2} to produce the corresponding oxidized states. However, with diminished Mn{sup II} loading in the reconstitution, there is no evidence for Mn occupancy of site 2, and the greater activity of these 'low-Mn' samples on a per-Mn basis implies that the {sup 1}Mn{sup IV}/{sup 2}Fe{sup III}-{beta} is at least the more active of the two oxidized forms and may be the only active form.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2015

From laser particle acceleration to the synthesis of extremely neutron rich isotopes via the novel fission-fusion mechanism

High-power, short pulse lasers have emerged in the last decade as attractive tools for accelerating charged particles (electrons, ions) to high energies over mm-scale acceleration lengths, thus promising to rival conventional acceleration techniques in the years ahead. In the first part of the article, the principles of laser-plasma interaction as well as the techniques and the current status of the acceleration of electron and ion beams will be briefly introduced. In particular with the upcoming next generation of multi-PW class laser systems, such as the one under construction for the ELI-Nuclear Physics project in Bucharest (ELI-NP), very efficient acceleration mechanisms for brilliant ion beams like radiation pressure acceleration (RPA) come into reach. Here, ultra-dense ion beams reaching solid-state density can be accelerated from thin target foils, exceeding the density of conventionally accelerated ion beams by about 14 orders of magnitude. This unique property of laser-accelerated ion beams can be exploited to explore the scenario of a new reaction mechanism called ‘fission-fusion’, which will be introduced in the second part of the article. Accelerating fissile species (e.g. {sup 232}Th) towards a second layer of the same material will lead to fission both of the beam-like and target-like particles. Due to the close to solid-state density of the accelerated ion bunches, fusion may occur between neutron-rich (light) fission products. This may open an access path towards extremely neutron-rich nuclides in the vicinity of the N=126 waiting point of the astrophysical r process. ‘Waiting points’ at closed nucleon shells play a crucial role in controlling the reaction rates. However, since most of the pathway of heavy-element formation via the rapid-neutron capture process (r-process) runs in ‘terra incognita’ of the nuclear landscape, in particular the waiting point at N=126 is yet unexplored and will remain largely inaccessible to conventional nuclear reaction schemes even at next-generation radioactive beam facilities, underlining the attractive perspectives offered, e.g., by ELI-NP.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2014

Infinitesimal Legendre symmetry in the Geometrothermodynamics programme

The work within the Geometrothermodynamics programme rests upon the metric structure for the thermodynamic phase-space. Such structure exhibits discrete Legendre symmetry. In this work, we study the class of metrics which are invariant along the infinitesimal generators of Legendre transformations. We solve the Legendre-Killing equation for a K-contact general metric. We consider the case with two thermodynamic degrees of freedom, i.e., when the dimension of the thermodynamic phase-space is five. For the generic form of contact metrics, the solution of the Legendre-Killing system is unique, with the sole restriction that the only independent metric function – Ω – should be dragged along the orbits of the Legendre generator. We revisit the ideal gas in the light of this class of metrics. Imposing the vanishing of the scalar curvature for this system results in a further differential equation for the metric function Ω which is not compatible with the Legendre invariance constraint. This result does not allow us to use Quevedo's interpretation of the curvature scalar as a measure of thermodynamic interaction for this particular class.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2023

A portable ion-energy diagnostic for transformative ARPA-E Fusion R&D

The Princeton Plasma Physics Laboratory seeks to develop a diagnostic to measure the energy distribution of ions (IED) in innovative confinement concept devices being investigated under ARAP-E grants. The Princeton Field-Reversed Configuration (PFRC) fusion project aims to develop small, simple, and clean fusion power generators in the 1–10 MW “micro-reactor” class. The PFRC explores a new approach to fusion power-generation design, prioritizing low radioactivity and modular units of MEW-scale power output. The team’s proposed power plant design provides a small footprint for a compact, potentially transportable energy source that is fully deployable and emissions-free. A critical diagnostic to accomplish this mission and to test the theory of ion heating necessary for fusion in PFRC reactors is called a stripping-cell ion-energy analyzer (SC-IEA).

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS2003

Runway Operations Planning: A Two-Stage Heuristic Algorithm

The airport runway is a scarce resource that must be shared by different runway operations (arrivals, departures and runway crossings). Given the possible sequences of runway events, careful Runway Operations Planning (ROP) is required if runway utilization is to be maximized. From the perspective of departures, ROP solutions are aircraft departure schedules developed by optimally allocating runway time for departures given the time required for arrivals and crossings. In addition to the obvious objective of maximizing throughput, other objectives, such as guaranteeing fairness and minimizing environmental impact, can also be incorporated into the ROP solution subject to constraints introduced by Air Traffic Control (ATC) procedures. This paper introduces a two stage heuristic algorithm for solving the Runway Operations Planning (ROP) problem. In the first stage, sequences of departure class slots and runway crossings slots are generated and ranked based on departure runway throughput under stochastic conditions. In the second stage, the departure class slots are populated with specific flights from the pool of available aircraft, by solving an integer program with a Branch & Bound algorithm implementation. Preliminary results from this implementation of the two-stage algorithm on real-world traffic data are presented.

Anagnostakis, Ioannis↗
DOE OSTI2023

A Li-rich layered oxide cathode with negligible voltage decay

With high capacity at low cost, Li- and Mn-rich (LMR) layered oxides are a promising class of cathodes for next generation Li-ion batteries. However, substantial voltage decay during cycling, due to the unstable Li 2 MnO 3 honeycomb structure, is still an obstacle for their practical deployment. Here we report a Co-free LMR Li-ion battery cathode without voltage decay. The material has a composite structure consisting of layered LiTMO 2 and various stacked Li 2 MnO 3 components, where transition metal (TM) ions partially reside in the Li layers of Li 2 MnO 3 , serving as a “cap” to strengthen the stability of the honeycomb structure. This unique capped-honeycomb structure is persistent after high-voltage cycling and prevents TM migration and oxygen loss, as shown by experimental and computational results. Furthermore, this work demonstrates that the long-standing voltage decay problem in LMRs can be effectively eliminated by internally pinning the honeycomb structure, which opens an avenue to developing nextgeneration high-energy cathode materials.

25 ENERGY STORAGE↗
DOE OSTI2019

Controlling the structure and photophysics of fluorophore dimers using multiple cucurbit[8]uril clampings

A modular strategy has been employed to develop a new class of fluorescent molecules, which generates discrete, dimeric stacked fluorophores upon complexation with multiple cucurbit[8]uril macrocycles. The multiple constraints result in a “static” complex (remaining as a single entity for more than 30 ms) and facilitate fluorophore coupling in the ground state, showing a significant bathochromic shift in absorption and emission. This modular design is surprisingly applicable and flexible and has been validated through an investigation of nine different fluorophore cores ranging in size, shape, and geometric variation of their clamping modules. All fluorescent dimers evaluated can be photo-excited to atypical excimer-like states with elongated excited lifetimes (up to 37 ns) and substantially high quantum yields (up to 1). This strategy offers a straightforward preparation of discrete fluorophore dimers, providing promising model systems with explicitly stable dimeric structures and tunable photophysical features, which can be utilized to study various intermolecular processes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2019

Does Chemical Engineering Research Have a Reproducibility Problem?

Concerns have been raised in multiple scientific fields in recent years about the reproducibility of published results. Systematic efforts to examine this issue have been undertaken in biomedicine and psychology, but less is known about this important issue in the materials-oriented research that underpins much of modern chemical engineering. Here, we relate a dramatic historical episode from our own institution to illustrate the implications of performing reproducible research and describe two case studies based on literature analysis to provide concrete information on the reproducibility of modern materials-oriented research. The two case studies deal with the properties of metal-organic frameworks (MOFs), a class of materials that have generated tens of thousands of papers. We do not claim that research on MOFs is less (or more) reproducible than other subfields; rather, we argue that the characteristics of this subfield are common to many areas of materials-oriented research. We conclude with specific recommendations for action by individual researchers, journal editors, publishers, and research communities.

catalysis (heterogeneous), defects, membrane, carb↗
DOE OSTI2017

Futility

The Futility package contains the following: 1) Definition of the size of integers and real numbers; 2) A generic Unit test harness; 3) Definitions for some basic extensions to the Fortran language: arbitrary length strings, a parameter list construct, exception handlers, command line processor, timers; 4) Geometry definitions: point, line, plane, box, cylinder, polyhedron; 5) File wrapper functions: standard Fortran input/output files, Fortran binary files, HDF5 files; 6) Parallel wrapper functions: MPI, and Open MP abstraction layers, partitioning algorithms; 7) Math utilities: BLAS, Matrix and Vector definitions, Linear Solver methods and wrappers for other TPLs (PETSC, MKL, etc), preconditioner classes; 8) Misc: random number generator, water saturation properties, sorting algorithms.

Collins, BenjaminS.↗
DOE OSTI2020

Bindee

Bindee is a clang tool that outputs a simple pybind11 template given a C++ file for efficient generation of C++-Python bindings. Bindee is intended to be a helper tool for minimizing initial user effort and safeguarding against common runtime errors. Bindee relies on two open-source software to produce bindings. Clang's LibTooling enables bindee to traverse a C++ file's AST to pick out bindable variables and functions, or "bindees." PyBind11 is templated, header-only library for generating C++-Python bindings for variables and functions. Operating purely in C++, bindee does not require learning any new API for accomplishing its task. Additionally, picking the correct pybind11 API for a given bindable element is handled without interaction from the user. Any user input is denoted by '@TEXT@' string substitution. Bindee is capable of generating modular bindings for public class methods, public class variables, enumerations, and free functions and variables. Bindings for templates are also supported. For those familiar with pybind11, bindee does not handle trampolines, C++ extensions through lambdas, or custom type casters.

Kimkno, JasonS.↗
DOE OSTI2014

Potential New Ligand Systems for Binding Uranyl Ions in Seawater Environments

Work began this quarter on a new project involving a combined computational and biosynthetic approach to selective recognition of uranyl ion in aqueous solution. This project exploits the results of computational studies to discover new ligand classes. Synthetic studies will follow to generate target systems for uranyl binding and determination of binding constants. The process will be iterative, with results from computation informing synthesis, and vice versa. The theme of the ligand classes to be examined initially will be biologically based. New phosphonate-containing α-amino acid N-carboxyanhydride (NCA) monomers were used recently to prepare well-defined phosphonate-containing poly-peptides and block copolypeptides. Our first approach is to utilize these phosphate- and phosphonate-containing NCAs for the coordination of uranyl. The work includes the laboratory-scale preparation of a series of NCAs and the full thermodynamic and spectroscopic characterization of the resulting uranyl complexes. We are also evaluating the sequestering activity in different physiological and environmental conditions of these copolymers as well as their biodegradability.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗