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Results for “Michael Addition”

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 181 records · Page 10

Twins in rotational spectroscopy: Does a rotational spectrum uniquely identify a molecule?

Rotational spectroscopy is the most accurate method for determining structures of molecules in the gas phase. It is often assumed that a rotational spectrum is a unique “fingerprint” of a molecule. The availability of large molecular databases and the development of artificial intelligence methods for spectroscopy make the testing of this assumption timely. In this paper, we pose the determination of molecular structures from rotational spectra as an inverse problem. Within this framework, we adopt a funnel-based approach to search for molecular twins, which are two or more molecules, which have similar rotational spectra but distinctly different molecular structures. Here we demonstrate that there are twins within standard levels of computational accuracy by generating rotational constants for many molecules from several large molecular databases, indicating that the inverse problem is ill-posed. However, some twins can be distinguished by increasing the accuracy of the theoretical methods or by performing additional experiments.

74 ATOMIC AND MOLECULAR PHYSICS↗

National Demonstration Reactor Siting Study—Phase I (Revision 1)

In 2020, the Department of Energy Office of Nuclear Energy (DOE-NE) initiated the Advanced Reactor Demonstration Program (ARDP), with the goal of demonstrating two advanced reactor designs within the next five to seven years. When evaluating challenges in meeting this deadline, the newly established National Reactor Innovation Center (NRIC) determined that there was a limited number of well-characterized sites that could support this time-sensitive demonstration requirement. To close this gap, NRIC initiated a two-phase joint analytic effort including DOE, National Laboratory, and academic partners to examine demonstration reactor siting alternatives. The first phase of the study, which is documented in this report, describes the development of a methodology for site assessment and a preliminary assessment of a limited number of known siting alternatives. Revision 1 of this report includes 3 additional (13 total) siting alternatives and 2 additional (4 total) example scenarios.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Predicting Pit Stability On Additively Manufactured SS316 Via Finite Element Modeling [Slides]

Pit growth and repassivation are complex, with many interconnecting geometric and environmental parameters to consider. Experimentally, it is difficult to isolate these individual parameters to study their effect on the stability of pits. To enable these studies, a finite element modeling approach has been developed to allow systematic testing of parameters that impact a pit’s stability. The specific parameters studied were the cathode diameter, the pit diameter and shape, and the water layer thickness. Hemispherical and rectangular-based pits were studied to determine the impact of the overall pit shape. Pit stability results were compared with mathematical calculations based on the Maximum Pit Model, for both 50% saturation and 100% saturated salt film coverage. Further studies expanded the range of pit geometry to those relevant to additively manufactured surfaces.

36 MATERIALS SCIENCE↗

Process and Applications Development for Recycled Mixed-Stream Composites

The goal of this IACMI Phase II Technical Collaboration Project was to establish the viability of producing affordable, recycled composite parts, which were produced from fibers with the properties in the range of those reclaimed through the controlled pyrolysis technology demonstrated in Phase I [1]. For the purpose of this report, we use the terms “recovered carbon fiber” (rCF) and “recovered glass fiber” (rGF) as the material reclaimed from controlled pyrolysis. This fiber recycling technology utilizes the inherent energy in composites for fuel and preserves the structural value of glass fiber (GF) and carbon fiber (CF) for reuse. It can also be used for recycling other waste streams at the same facility, thus spreading capital risk and recovery across multiple industries and achieving economy of scale. A second goal to be addressed was the viability of using recycled fibers as reinforcing materials in additive manufacturing applications.

36 MATERIALS SCIENCE↗

Noise driven emittance growth with coherent forces

Noise driven emittance growth is modified by the presence of coherent forces. Closed form asymptotic growth rates are given for two frequency distributions. The analytic results are compared with tracking, showing good agreement. Purely numerical results for a parabolic frequency distribution are also presented. If a small antidamping force is present then additional, real frequency shifts increase growth rates.

43 PARTICLE ACCELERATORS↗

Global impact of the Antarctic ozone hole - Chemical propagation

A model is presented for the chemical mixing of stratospheric air, that combines photochemistry, molecular diffusion, and strain (i.e., the stretching of air parcels due to wind shear). The model is applied to the case in which chemically perturbed air parcels from the Antarctic stratosphere are transported to mid-latidudes and strained into thin ribbon-like filaments until they are diffusively mixed with the ambient stratosphere. Results show that, following the breakup of the polar vortex, Antarctic air with substantially depleted ozone will not contribute any additional ozone loss at mid-latitudes as it is mixed with ambient air, supporting the results of simulations of the Antarctic ozone hole by Prather et al. (1990). Nevertheless, air processed by polar stratospheric clouds but transported to mid-latitudes before substantive ozone depletion, can lead to additional loss after mixing with ambient air.

Prather, Michael↗

Micro Weather Station

Improved in situ meteorological measurements in the troposphere and stratosphere are needed for studies of weather and climate, both as a primary data source and as validation for remote sensing instruments. Following the initial development and successful flight validation of the surface acoustic wave (SAW) hygrometer, the micro weather station program was directed toward the development of an integrated instrument, capable of accurate, in situ profiling of the troposphere, and small enough to fly on a radiosonde balloon for direct comparison with standard radiosondes. On April 23, 1998, working with Frank Schmidlin and Bob Olson of Wallops Island Flight Facility, we flew our instrument in a dual payload experiment, for validation and direct comparison with a Vaisala radiosonde. During that flight, the SAW dewpoint hygrometer measured frostpoint down to -76T at 44,000 feet. Using a laptop computer in radio contact with the balloon, we monitored data in real time, issued the cutdown command, and recovered the payload less than an hour after landing in White Sands Missile Range, 50 miles from the launch site in Hatch, New Mexico. Future flights will extend the intercomparison, and attempt to obtain in situ meteorological profiles from the surface through the tropopause. The SAW hygrometer was successfully deployed on the NASA DC8 as part of NASA's Third Convection and Moisture Experiment (CAMEX-3) during August and September, 1998. This field campaign was devoted to the study of hurricane tracking and intensification using NASA-funded aircraft. In situ humidity data from the SAW hygrometer are currently being analyzed and compared with data from other instruments on the DC8 and ER2 aircraft. Additional information is contained in the original.

Hoenk, Michael E.↗

The Development and Application of a Method to Quantify the Quality of Cryoprotectant Conditions Using Standard Area Detector X-Ray Images

An X-ray based method for determining cryoprotectant concentrations necessary to protect solutions from crystalline ice formation was developed. X-ray images from a CCD area detector were integrated as powder patterns and quantified by determining the standard deviation of the slope of the normalized intensity curve in the resolution range where ice rings are known to occur. The method was tested determining the concentrations of glycerol, PEG400, ethylene glycol and 1,2-propanediol necessary to form an amorphous glass at 1OOK with each of the 98 crystallization solutions of Crystal Screens I and II (Hampton Research, Laguna Hills, California, USA). For conditions that required glycerol concentrations of 35% or above cryoprotectant conditions using 2,3-butanediol were determined. The method proved to be remarkably accurate. The results build on the work of [Garman and Mitchell] and extend the number, of suitable starting conditions to alternative cryoprotectants. In particular, 1,2-propanediol has emerged as a particularly good additive for glass formation upon flash cooling.

McFerrin, Michael↗

An Anomalous External Force on the MAP Spacecraft

A common theme in discussions of the Microwave Anisotropy Probe (MAP) is the attainment of mission goals for minimal cost. One area of cost savings was a reduction in the fuel budget required. To reach orbit around the L2 notation point of the Earth-Sun system, the MAP spacecraft was guided very close to the Moon, allowing a gravity-assisted trajectory out to L2. In order to property time the lunar swing-by, MAP followed a trajectory of three-and-a-half highly elliptical phasing loops. At each perigee of this trajectory MAP executed a thruster maneuver to increase orbit velocity; maneuvers were required at one or both clothe first two perigees (called P1 and P2) and at the third and final perigee (P-final). The preference was for successful maneuvers at all three perigees because this scheme provided a small, additional fuel savings.

Starin, Scott R.↗

A Primer on Argument Assessment

This paper follows up A Primer on Argument by providing introductory information about how to assess arguments. The structure is as follows. The opening section identifies and summarizes prerequisite information a reader needs to understand to understand this document. Section 2 introduces a way (but not the only way) to assess atomic arguments. Section 3 does the same for compound arguments. Section 4 wraps everything up. Appendix A collects the crucial information in one place. Appendix B explicates a detailed assessment example. The paper is published as a white paper because it is intended to be updated as additional experience is gained with its use.

argument↗

Numerical Evaluation of Entry System Trajectory Control via Active Porosity Control of Transpiration Cooled Thermal Protection System

As space exploration expands, atmospheric descent requirements will tighten to improve landing accuracy to areas of interest. One way to meet higher landing accuracy requirements is by increasing vehicle maneuverability. This study explores the concept of manipulating a transpiration cooling scheme for entry capsules that could provide both active aerodynamic control as well as thermal protection for external surfaces. Numerical methods of fluid dynamics and heat transfer are presented to study the effectiveness of the concept in both thermal protection and entry vehicle attitude control. This effort works through development of an entry vehicle model at aeromaneuvering conditions with designated boundary activated for effects of transpiration cooling. Preliminary results show calculated values of heat flux and aerodynamic forces as a function of varying transpiration cooling flow rates. This contributes evidence of asymmetric cooling utilization as an additional mechanism for vehicle attitude control.

Caroline Anderson↗

Investigation of the Impedance Characteristics of Perforate Sheet Hole Clustering Over an Array of Uniform Depth Chambers

A series of normal incidence impedance tube tests are conducted to characterize the facesheet impedance differences between uniformly distributed and nonuniformly tightly packed hole layout patterns, defined here as "hole clustering." These hole clustered samples contain the same number of holes as their uniformly distributed counterparts but target edge to edge distances between holes down to 0.01". Resonant frequency shifts between uniformly distributed and hole clustered samples are presented to demonstrate potential design benefits. Mass end correction differences between samples are also shown to better quantify differences in designs, including the effect of acoustic particle velocity. It is found that hole clustered facesheets over an array of uniform depth chambers can provide significant reactance increases at minimal expense to resistance, thereby lowering resonant frequencies. Additionally, moving these hole clustered layouts toward common chamber corners provides additional resonance shifts to lower frequencies.

acoustic liner impedance hole clustering perforate↗