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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 217 records · Page 12

A quantum model for bending vibrations and thermodynamic properties of C3.

The investigation reported was conducted to clarify the thermodynamic properties of C3 by further developing the limit to the partition function suggested by Strauss and Thiele (1967). A quantum solution for the energy levels of a quadratically perturbed square well potential is presented and the consistency of this limit with observed energy levels is established. In the process a more complete physical picture of the bending C3 molecules emerges. The values of entropy deduced from various measurements of graphite pressure are compared with this limit, and the thermodynamic properties predicted for the limiting case are evaluated.

Hansen, C. F.↗

Ames S-32 O-16 O-18 Line List for High-Resolution Experimental IR Analysis

By comparing to the most recent experimental data and spectra of the SO2 628 ν1/ν3 bands (see Ulenikov et al., JQSRT 168 (2016) 29-39), this study illustrates the reliability and accuracy of the Ames-296K SO2 line list, which is accurate enough to facilitate such high-resolution spectroscopic analysis. The SO2 628 IR line list is computed on a recently improved potential energy surface (PES) refinement, denoted Ames-Pre2, and the published purely ab initio CCSD(T)/aug-cc-pVQZ dipole moment surface. Progress has been made in both energy level convergence and rovibrational quantum number assignments agreeing with laboratory analysis models. The accuracy of the computed 628 energy levels and line list is similar to what has been achieved and reported for SO2 626 and 646, i.e. 0.01-0.03 cm(exp −1) for bands up to 5500 cm(exp −1). During the comparison, we found some discrepancies in addition to overall good agreements. The three-IR-list based feature-by-feature analysis in a 0.25 cm(exp −1) spectral window clearly demonstrates the power of the current Ames line lists with new assignments, correction of some errors, and intensity contributions from varied sources including other isotopologues. We are inclined to attribute part of detected discrepancies to an incomplete experimental analysis and missing intensity in the model. With complete line position, intensity, and rovibrational quantum numbers determined at 296 K, spectroscopic analysis is significantly facilitated especially for a spectral range exhibiting such an unusually high density of lines. The computed 628 rovibrational levels and line list are accurate enough to provide alternatives for the missing bands or suspicious assignments, as well as helpful to identify these isotopologues in various celestial environments. The next step will be to revisit the SO2 828 and 646 spectral analyses.

Sulfur dioxide↗

Study of electronic properties in proton- and electron-irradiated GaAlAs and GaAs solar cell materials

Diagnostical measurement techniques such as dark I-V, C-V, the thermally insulated capacitance, and the deep level transient spectroscopy methods were employed to study defect properties in the proton-irradiated n-GaAs materials. Defect energy levels, thermal emission rates, and capture cross sections of electrons as well as trap densities were deduced from these measurements and the results are presented. Correlations between the measured defect parameters and the dark I-V characteristics of the n-GaAs Schottky barrier diodes are also discussed. Defect energy levels (i.e., electron traps) determined are also compared with published data in order to identify their physical origins.

Li, S. S.↗

The Foundational Industry Energy Dataset: Unit-level Characterization and Derived Energy Estimates for Industrial Facilities in 2017

The Foundational Industry Energy Dataset (FIED) addresses several of the areas of growing disconnect between the demands of industrial energy analysis and the state of industrial energy data by providing unit-level characterization by facility. Each facility is identified by a unique registryID, based on the U.S. Environmental Protection Agency (EPA) Facility Registry Service, and includes its coordinates and other geographic identifiers. Energy-using units are characterized by design capacity, as well as their estimated energy use, greenhouse gas emissions, and physical throughput using 2017 data from the EPA's National Emissions Inventory and Greenhouse Gas Reporting Program. An overview of the derivation methods is provided in a separate technical report which will be linked after publication. The Python code used to compile the dataset is available in a GitHub repository. An updated 2020 version is under development.

Array↗

Identification of the defect dominating high temperature reverse leakage current in vertical GaN power diodes through deep level transient spectroscopy

Deep level defects in wide bandgap semiconductors, whose response times are in the range of power converter switching times, can have a significant effect on converter efficiency. We use Deep Level Transient Spectroscopy (DLTS) to evaluate such defect levels in the n- drift layer of vertical GaN (v-GaN) power diodes with VBD ~ 1500 V. DLTS reveals three energy levels that are at ~0.6 eV (highest density), ~0.27 eV (lowest density) and ~ 45 meV (a dopant level) from the conduction band. Dopant extraction from Capacitance-Voltage measurement test (C-V) at multiple temperatures enables trap density evaluation, and the ~0.6 eV trap has a density of 1.2 × 10 15 cm -3 . Here, the 0.6 eV energy level and its density are similar to a defect that is known to cause current collapse in GaN based surface conducting devices (like HEMTs). Analysis of reverse bias currents over temperature in the v-GaN diodes indicates a predominant role of the same defect in determining reverse leakage current at high temperatures, reducing switching efficiency.

42 ENGINEERING↗

Research on Spectroscopy, Opacity, and Atmospheres

For planetary and telluric atmosphere projects the solar irradiance spectrum is required as the input at the top of the atmosphere. It has never been observed. People ask me to compute it. I can compute it theoretically using both known and predicted lines and get agreement averaged over a nanometer but there is no way to predict the resolved spectrum when only half the lines are known. In other stars the situation is worse because the signal-to-noise and resolution of the observations are worse. Logically one has to know a priori what is in the spectrum in order to interpret it; there is not enough information in the observed spectrum itself (qualifiers are given). Basically we need a list of all the energy levels of all atoms and molecules that matter. From that list can be generated all the lines. With the energy levels and line positions known, one can measure gf values, lifetimes, damping, or one can determine a theoretical or semiempirical Hamiltonian whose eigenvalues and eigenvectors produce a good match to the observed data, and that can then be used to generate additional radiative and collisional data for atoms or molecules.

Kurucz, Robert L.↗

Lowly Fused Non-Fullerene Acceptors Towards Efficient Organic Solar Cells Enabled by Isomerization

Here two lowly fused non-fullerene acceptors (NFAs) with isomeric structures, named as BTP-out-4F and BTP-in-4F, were developed by tailoring the fused 7-ring central core of Y6 into a lowly fused 5-ring linked with two octyloxythiophene bridges. BTP-out-4F with octyloxy side chains away from the central core exhibited large steric hindrance that restrained the rotational freedom between the thiophene bridge and end group but maintained free rotation between the central core and the thiophene bridge. In contrast, BTP-in-4F with octyloxy side chains close to the central core had much lower rotation freedom due to the non-covalent S … O interactions locked the central core, thiophene bridge and end group simultaneously, making BTP-in-4F have higher molecular crystallinity. On the other hand, the optical properties, energy levels and the blend morphology properties were significantly influenced, leading to distinctive photovoltaic performances. BTP-out-4F formed favorable energy level alignment and morphology when matching with PBDB-T donor, thus its device realized a much higher PCE of 13.32%, which was over 13 times than that of BTP-in-4F based device (PCE=0.97%).

36 MATERIALS SCIENCE↗

Design, fabrication, installation and flight service evaluation of a composite cargo ramp skin on a model CH-53 helicopter

The installation of a composite skin panel on the cargo ramp of a CH-530 marine helicopter is discussed. The composite material is of Kevlar/Epoxy (K/E) which replaces aluminum outer skins on the aft two bays of the ramp. The cargo ramp aft region was selected as being a helicopter airframe surface subjected to possible significant field damage and would permit an evaluation of the long term durability of the composite skin panel. A structural analysis was performed and the skin shears determined. Single lap joints of K/E riveted to aluminum were statically tested. The joint tests were used to determine bearing allowables and the required K/E skin gage. The K/E skin panels riveted to aluminum edge members were tested in a shear fixture to confirm the allowable shear and bearing strengths. Impact tests were conducted on aluminum skin panels to determine energy level and damage relationship. The K/E skin panels of various ply orientations and laminate thicknesses were then impacted at similar energy levels. The results of the analysis and tests were used to determine the required K/E skin gages in each of the end two bays of the ramp.

Lowry, D. W.↗

Low-Light-Shift Cesium Fountain without Mechanical Shutters

A new technique for reducing errors in a laser-cooled cesium fountain frequency standard provides for strong suppression of the light shift without need for mechanical shutters. Because mechanical shutters are typically susceptible to failure after operating times of the order of months, the elimination of mechanical shutters could contribute significantly to the reliability of frequency standards that are required to function continuously for longer time intervals. With respect to the operation of an atomic-fountain frequency standard, the term "light shift" denotes an undesired relative shift in the two energy levels of the atoms (in this case, cesium atoms) in the atomic fountain during interrogation by microwaves. The shift in energy levels translates to a frequency shift that reduces the precision and possibly accuracy of the frequency standard. For reasons too complex to describe within the space available for this article, the light shift is caused by any laser light that reaches the atoms during the microwave- interrogation period, but is strongest for near-resonance light. In the absence of any mitigating design feature, the light shift, expressed as a fraction of the standard fs frequency, could be as large as approx. 2 x 10(exp -11), the largest error in the standard. In a typical prior design, to suppress light shift, the intensity of laser light is reduced during the interrogation period by using a single-pass acoustooptic modulator to deflect the majority of light away from the main optical path. Mechanical shutters are used to block the remaining undeflected light to ensure complete attenuation. Without shutters, this remaining undeflected light could cause a light shift of as much as .10.15, which is unacceptably large in some applications. The new technique implemented here involves additionally shifting the laser wavelength off resonance by a relatively large amount (typically of the order of nanometers) during microwave interrogation. In this design, when microwave interrogation is not underway, the atoms are illuminated by a slave laser locked to the lasing frequency of a lower power master laser.

Enzer, Daphna↗

Local Power: Comparing County-Level Renewable Energy Potential to Consumption Using the SLOPE Platform

Wide-scale deployment of renewable energy technologies has the potential to significantly reduce greenhouse gas emissions and mitigate the effects of climate change. Many communities have ambitious clean energy goals with targets for locally generated renewable energy. To inform state and local clean energy planning, analysts from the Joint Institute for Strategic Energy Analysis (JISEA) and National Renewable Energy Laboratory (NREL) used data from NREL's State and Local Planning for Energy (SLOPE) platform to compare annual technical generation potential of renewable energy technologies to modeled electricity consumption in every county of the contiguous United States. Annual costs were calculated to produce a 20% share of electricity consumed annually from each technology to examine localized cost effectiveness of a diversified mix of generation sources. For example, combining distributed and utility-scale wind and solar generation can offset the need for storage and nonintermittent fossil resources to achieve high deployment of renewables. This county-level analysis provides insight into where localized renewable energy generation could cost-effectively match annual electricity consumption.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Inkjet-printed SnO x as an effective electron transport layer for planar perovskite solar cells and the effect of Cu doping

Inkjet printing is a more sustainable and scalable fabrication method than spin coating for producing perovskite solar cells (PSCs). Although spin-coated SnO 2 has been intensively studied as an effective electron transport layer (ETL) for PSCs, inkjet-printed SnO 2 ETLs have not been widely reported. Here, we fabricated inkjet-printed, solution-processed SnO x ETLs for planar PSCs. A champion efficiency of 17.55% was achieved for the cell using a low-temperature processed SnO x ETL. The low-temperature SnO x exhibited an amorphous structure and outperformed high-temperature crystalline SnO 2 . The improved performance was attributed to enhanced charge extraction and transport and suppressed charge recombination at ETL/perovskite interfaces, which originated from enhanced electrical and optical properties of SnO x , improved perovskite film quality, and well-matched energy level alignment between the SnO x ETL and the perovskite layer. Furthermore, SnO x was doped with Cu. Cu doping increased surface oxygen defects and upshifted energy levels of SnO x , leading to reduced device performance. A tunable hysteresis was observed for PSCs with Cu-doped SnO x ETLs, decreasing at first and turning into inverted hysteresis afterwards with increasing Cu doping level. This tunable hysteresis was related to the interplay between charge/ion accumulation and recombination at ETL/perovskite interfaces in the case of electron extraction barriers.

14 SOLAR ENERGY↗

Vertical distribution of vibrational energy of molecular nitrogen in a stable auroral red arc and its effect on ionospheric electron densities

Previous solutions of the problem of the distribution of vibrationally excited molecular nitrogen in the thermosphere have either assumed a Boltzmann distribution and considered diffusion as one of the loss processes or solved for the energy level populations and neglected diffusion. Both of the previous approaches are combined by solving the time dependent continuity equations, including the diffusion process, for the first six energy levels of molecular nitrogen for conditions in the thermosphere corresponding to a stable auroral red arc. The primary source of molecular nitrogen excitation was subexcitation, and inelastic collisions between thermal electrons and molecular nitrogen. The reaction rates for this process were calculated from published cross section calculations. The loss processes for vibrational energy were electron and atomic oxygen quenching and vibrational energy exchange. The coupled sets of nonlinear, partial differential equations were solved numerically by employing finite difference equations.

Newton, G. P.↗

Compression failure characteristics of + or - 45-deg-dominated laminates with a circular hole or impact damage

An investigation of the compression failure characteristics of + or - 45-deg-dominated laminates with a circular hole or impact damage was conducted. Graphite-epoxy laminates consisting of all + or - 45-deg plies and of + or - 45-deg and 90-deg plies were evaluated. Inplane shearing between the fibers and matrix (i.e., matrix shearing) was found to be the primary compression failure mechanism for an all + or - 45-deg laminate with a hole. The failure mechanism for the + or 45-deg-dominated laminates with a hole appeared to be a combination of delamination and matrix shearing. The compression failure stresses and strains for both the all + or - 45-deg laminate and the + or - 45-deg-dominated laminates were unaffected by impact damage at an energy level of 5.5 J when compared to results for undamaged control specimens. The failure stresses and strains for all laminates with impact damage at an energy level of 17.0 J or of 34.3 J were significantly lower than the corresponding data for the undamaged control specimens. The failure stresses and strains for these impact-damaged specimens were independent of the percentage of 90-deg plies in the laminate.

Shuart, M. J.↗

Quantifying Charge Carrier Localization in PBTTT Using Thermoelectric and Spectroscopic Techniques

Chemically doped poly[2,5-bis(3-alkylthiophen-2-yl)thieno[3,2- b ]thiophene] (PBTTT) shows promise for many organic electronic applications, but rationalizing its charge transport properties is challenging because conjugated polymers are inhomogeneous, with convoluted optical and solid-state transport properties. Herein, we use the semilocalized transport (SLoT) model to quantify how the charge transport properties of PBTTT change as a function of iron(III) chloride (FeCl 3 ) doping level. We use the SLoT model to calculate fundamental transport parameters, including the carrier density needed for metal-like electrical conductivities and the position of the Fermi energy level with respect to the transport edge. We then contextualize these parameters with other polymer-dopant systems and previous PBTTT reports. Additionally, we use grazing incidence wide-angle X-ray scattering and spectroscopic ellipsometry techniques to better characterize inhomogeneity in PBTTT. Our analyses indicate that PBTTT obtains high electrical conductivities due to its quickly rising reduced Fermi energy level, and this rise is afforded by its locally high carrier densities in highly ordered microdomains. Ultimately, this report sets a benchmark for comparing transport properties across polymer-dopant-processing systems.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Microscopic origin of criticality at macroscale in QCD chiral phase transition

We reveal that the criticality of the chiral phase transition in QCD at the macroscale arises from the microscopic energy levels of its fundamental constituents, the quarks. We establish a novel relation between cumulants of the chiral order parameter (i.e., chiral condensate) and correlations among the energy levels of quarks (i.e., eigenspectra of the massless Dirac operator), which naturally leads to a generalization of the Banks-Casher relation. Based on this novel relation and through (2+1)-flavor lattice QCD calculations using the HISQ action with varying light quark masses in the vicinity of the chiral phase transition, we demonstrate that the correlations among the infrared part of the Dirac eigenspectra exhibit same universal scaling behaviors as expected of the cumulants of the chiral condensate. We find that these universal scaling behaviors extend up to the physical values of the up and down quark masses.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Impulse Measurements of Electric Solid Propellant in an Electrothermal Ablation-Fed Pulsed Plasma Thruster

Electric solid propellants are advanced solid chemical rocket propellants that can be controlled (ignited, throttled and extinguished) through the application and removal of an electric current. These propellants are also being considered for use in the ablative pulsed plasma thruster. In this paper, the performance of an electric solid propellant operating in an electrothermal ablation-fed pulsed plasma thruster was investigated using an inverted pendulum micro-Newton thrust stand. The impulse bit and specific impulse of the device using the electric solid propellant were measured for short-duration test runs of 100 pulses and longer-duration runs to end-of-life, at energy levels of 5, 10, 15 and 20 J. Also, the device was operated using the current state-of-the-art ablation-fed pulsed plasma thruster propellant, polytetrafluoroethylene or PTFE. Impulse bit measurements for PTFE indicate 100±20 μN-s at an initial energy level of 5 J, which increases linearly by ~30 μN-s/J with increased initial energy. Measurements of the impulse bit for the electric solid propellant are on average lower than PTFE by 10% or less. Specific impulse for when operating on PTFE is calculated to be about 450 s compared to 225 s for the electric solid propellant. The 50% reduction in specific impulse is due to increased mass ablated during operation with the electric solid propellant relative to PTFE.

Glascock, Matthew S.↗

The Effects of Impactor Shape on the Compression After Impact Strength of Carbon/Epoxy Face Sheet Foam Core Sandwich Structure

This study presents experimental results of compression after impact (CAI) strength testing of foam core sandwich structure with carbon/epoxy face sheets impacted at three different energies with either a blunt or sharp tip impactor. The impact energies used were chosen to span the barely visible impact damage (BVID) thresholds for the sharp (4.1 J) and blunt (12.9 J) impactors with an impact energy approximately halfway between these (8.1 J) also used. While most impact testing on composites utilize a hemispherical (blunt) impactor, actual damage to a part may be due to an object impacting the part that is not blunt, but sharp and the impact response and resulting CAI strength values may be different for a given impact energy level. In this study, with regards to the impact response, the sandwich specimens showed larger transverse displacements (by about a factor of two) during the impact event when impacted by a sharp impactor versus a blunt impactor. The maximum load of impact was larger for the blunt impactor by about a factor of three. The barely visible impact damage (BVID) threshold energy was lower by about a factor of three for the sharp impactor. The absorbed energy of impact was higher for the sharp impactor. The CAI strength results showed that the sharp impactor gave lower average CAI strength values at the lowest impact energy level used, slightly lower average CAI strength values for the medium impact energy used and about the same average CAI strength values for the highest impact energy used.

sandwich structure↗