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DOE OSTI2023

A COUPLED DETERMINISTIC TRANSPORT CALCULATION IN COMSOL USING PROPER ORTHOGONAL DECOMPOSITION

A coupled physics problem consisting of radiation transport and heat transfer was modeled using COMSOL Multiphysics to simulate a criticality accident. Reduced order models (ROM) were created to accelerate the radiation transport calculation through Proper Orthogonal Decomposition (POD). Additionally, on-the-fly neutron cross sections were generated from a non-linear function through a feed forward neural network. The Livelink for MATLAB module allowed for data transfer between an otherwise independent solver and in-house modules. A data driven approach to POD was developed to act as a surrogate model to couple with heat transfer, with the POD module written in MATLAB coupled to an isolated heat transfer solve in COMSOL. A coupled transient solution resulted in a good approximation of the flux and temperature, with the maximum error being 3E-2 and 2.5E-3 respectively.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

NASA NTRS1979

Directional spectra of ocean waves from microwave backscatter: A physical optics solution with application to the short-pulse and two-frequency measurement techniques

Two simple microwave radar techniques that are potentially capable of providing routine satellite measurements of the directional spectrum of ocean waves were developed. One technique, the short pulse technique, makes use of very short pulses to resolve ocean surface wave contrast features in the range direction; the other technique, the two frequency correlation technique makes use of coherency in the transmitted waveform to detect the large ocean wave contrast modulation as a beat or mixing frequency in the power backscattered at two closely separated microwave frequencies. A frequency domain analysis of the short pulse and two frequency systems shows that the two measurement systems are essentially duals; they each operate on the generalized (three frequency) fourth-order statistical moment of the surface transfer function in different, but symmetrical ways, and they both measure the same directional contrast modulation spectrum. A three dimensional physical optics solution for the fourth-order moment was obtained for backscatter in the near vertical, specular regime, assuming Gaussian surface statistics.

Jackson, F. C.↗

DOE OSTI2016

SU-G-IeP3-08: Image Reconstruction for Scanning Imaging System Based On Shape-Modulated Point Spreading Function

Purpose: Deconvolution is a widely used tool in the field of image reconstruction algorithm when the linear imaging system has been blurred by the imperfect system transfer function. However, due to the nature of Gaussian-liked distribution for point spread function (PSF), the components with coherent high frequency in the image are hard to restored in most of the previous scanning imaging system, even the relatively accurate PSF is acquired. We propose a novel method for deconvolution of images which are obtained by using shape-modulated PSF. Methods: We use two different types of PSF - Gaussian shape and donut shape - to convolute the original image in order to simulate the process of scanning imaging. By employing deconvolution of the two images with corresponding given priors, the image quality of the deblurred images are compared. Then we find the critical size of the donut shape compared with the Gaussian shape which has similar deconvolution results. Through calculation of tightened focusing process using radially polarized beam, such size of donut is achievable under same conditions. Results: The effects of different relative size of donut and Gaussian shapes are investigated. When the full width at half maximum (FWHM) ratio of donut and Gaussian shape is set about 1.83, similar resolution results are obtained through our deconvolution method. Decreasing the size of donut will favor the deconvolution method. A mask with both amplitude and phase modulation is used to create a donut-shaped PSF compared with the non-modulated Gaussian PSF. Donut with size smaller than our critical value is obtained. Conclusion: The utility of donutshaped PSF are proved useful and achievable in the imaging and deconvolution processing, which is expected to have potential practical applications in high resolution imaging for biological samples.

60 APPLIED LIFE SCIENCES↗

DOE OSTI2026

Control of Excitonic Energy Transfer in RGB Quantum Dot:Polymer Composites for Tunable White Emission

Tint-controlled white light is crucial for both illumination systems and display applications. Here, in this study, we demonstrate solution-processed quantum-dot light-emitting diodes (QD-LEDs) featuring a red–green–blue (RGB) QD–poly(methyl methacrylate) (PMMA) composite emissive layer (EML) for tunable white electroluminescence (EL). In this composite EML, PMMA functions as a dispersion matrix that modulates the interdot spacing (d), thereby controlling Förster resonance energy transfer (FRET) between QDs. By adjustment of the PMMA content, the balance of R, G, and B emissions is controlled, enabling systematic and continuous tuning of the EL color from greenish to reddish white at a fixed RGB ratio and constant driving bias. Time-resolved photoluminescence measurements confirm that the variation in the exciton lifetime with the PMMA fraction is the primary factor for tuning the EL color. Notably, nearly pure white EL with CIE coordinates close to (0.33, 0.33) is achieved using a diluted PMMA matrix without significant degradation of the electrical properties. Our results demonstrate d as an independent design parameter for decoupling color tuning from RGB composition and electrical operation, providing a versatile design framework for high-quality white- or tint-controlled QD-LEDs toward advanced solid-state lighting and display technologies.

36 MATERIALS SCIENCE↗

DOE OSTI2023

Electrochemistry at Back-Gated, Ultrathin ZnO Electrodes: Field-Effect Modulation of Heterogeneous Electron Transfer Rate Constants by 30× with Enhanced Gate Capacitance

We report steady-state voltammetry of outer-sphere redox species at back-gated ultrathin ZnO working electrodes in order to determine electron transfer rate constants k ET as a function of independently-controlled gate bias, V G . We demonstrate that k ET can be modulated as much as 30-fold by application of V G ≤ 8 V. Key to this demonstration was integrating the ultrathin (5 nm) ZnO on a high dielectric constant (k) insulator, HfO 2 (30 nm), which was grown on a Pd metal gate. The high-k HfO 2 dramatically decreased the required V G values and increased the gate-induced charge in ZnO compared to previous studies. Importantly, the enhanced gating power of the Pd/HfO 2 /ZnO stack meant it was possible to observe a non-monotonic dependence of k ET on V G , which reflects the inherent density of redox acceptor states in solution. Furthermore, this work adds to the growing body of literature demonstrating that electrochemical kinetics (i.e., rate constants and overpotentials) at ultrathin working electrodes can be tuned by V G , independent of the conventional electrochemical working electrode potential.

36 MATERIALS SCIENCE↗

DOE OSTI2015

Characteristic image quality of a third generation dual-source MDCT scanner: Noise, resolution, and detectability

Purpose: The purpose of this work was to assess the inherent image quality characteristics of a new multidetector computed tomography system in terms of noise, resolution, and detectability index as a function of image acquisition and reconstruction for a range of clinically relevant settings. Methods: A multisized image quality phantom (37, 30, 23, 18.5, and 12 cm physical diameter) was imaged on a SOMATOM Force scanner (Siemens Medical Solutions) under variable dose, kVp, and tube current modulation settings. Images were reconstructed with filtered back projection (FBP) and with advanced modeled iterative reconstruction (ADMIRE) with iterative strengths of 3, 4, and 5. Image quality was assessed in terms of the noise power spectrum (NPS), task transfer function (TTF), and detectability index for a range of detection tasks (contrasts of approximately 45, 90, 300, −900, and 1000 HU, and 2–20 mm diameter) based on a non-prewhitening matched filter model observer with eye filter. Results: Image noise magnitude decreased with decreasing phantom size, increasing dose, and increasing ADMIRE strength, offering up to 64% noise reduction relative to FBP. Noise texture in terms of the NPS was similar between FBP and ADMIRE (<5% shift in peak frequency). The resolution, based on the TTF, improved with increased ADMIRE strength by an average of 15% in the TTF 50% frequency for ADMIRE-5. The detectability index increased with increasing dose and ADMIRE strength by an average of 55%, 90%, and 163% for ADMIRE 3, 4, and 5, respectively. Assessing the impact of mA modulation for a fixed average dose over the length of the phantom, detectability was up to 49% lower in smaller phantom sections and up to 26% higher in larger phantom sections for the modulated scan compared to a fixed tube current scan. Overall, the detectability exhibited less variability with phantom size for modulated scans compared to fixed tube current scans. Conclusions: Image quality increased with increasing dose and decreasing phantom size. The CT system exhibited nonlinear noise and resolution properties, especially at very low-doses, large phantom sizes, and for low-contrast objects. Objective image quality metrics generally increased with increasing dose and ADMIRE strength, and with decreasing phantom size. The ADMIRE algorithm could offer comparable image quality at reduced doses or improved image quality at the same dose. The use of tube current modulation resulted in more consistent image quality with changing phantom size.

60 APPLIED LIFE SCIENCES↗

DOE OSTI2025

Pressure-Modulated Energy Transfer Dynamics in Mn 2+ -Doped CdS/ZnS Core/Shell Quantum Dots

Transition metal doping in semiconductor quantum dots (QDs) significantly impacts their optical properties, thus expanding the range of their potential optoelectronic applications. This study investigates the pressure-dependent energy transfer dynamics in Mn 2+ -doped CdS/ZnS core/shell QDs, focusing on how external hydrostatic pressure modulates these dynamics and optical properties. By synthesizing Mn 2+ -doped QDs with varying Mn 2+ doping concentrations, we explore the effects of the pressure on photoluminescence (PL) spectra and energy transfer efficiency. Our study reveals that increasing pressure induces a blueshift in the QD host bandgap PL and a redshift in the Mn 2+ dopant PL. The pressure-induced shifts highlight a unique modulation mechanism where the energy transfer efficiency decreases with pressure due to reduced wave function overlap between host excitons and Mn 2+ dopants. Detailed analysis of the PL quantum yields and energy transfer rate constants provides insights into these dynamics, suggesting that the pressure can effectively and reversibly regulate the energy transfer efficiencies and rates. In conclusion, these results have implications for developing pressure-sensitive configurable devices and exploring pressure-induced phenomena in doped nanomaterials.

36 MATERIALS SCIENCE↗

DOE OSTI2021

Photosynthetic reaction center variants made via genetic code expansion show Tyr at M210 tunes the initial electron transfer mechanism

Significance Reaction centers (RCs) are critical to photosynthetic energy conversion. RCs in all characterized photosynthetic organisms contain two symmetrically arranged branches of chromophores and enable light-induced electron transfer with high yield. We fine-tune the properties of a key bacterial RC symmetry-breaking tyrosine via its replacement with noncanonical tyrosine analogs and determine kinetic outcomes. Results are interpreted through energetic characterization made possible by resonance Stark spectroscopy. Analysis indicates this tyrosine modulates the mechanism of the initial light-induced electron transfer, affording an alternative functional pathway that maintains the RC’s robust electron transfer. Modern molecular biology, ultrafast spectroscopy, crystallography, and energetic characterization enable the mechanistic model we describe. Our results deepen understanding of RC function and may have implications for other photocatalysts and enzymes.

59 BASIC BIOLOGICAL SCIENCES↗

NASA NTRS1988

The dc power control for a liquid-fed resistojet

A simple breadboard power controller was designed and demonstrated for a new liquid-fed water resistojet. The 1-piece laboratory model thruster has an integrated vaporizer/superheater using a single heating element. Heater temperature was maintained at or near a preset reference value with the closed loop controller providing pulse width modulated (PWM) dc power into the thruster heater. A combined thruster, temperature readout, PWM transfer function was experimentally determined. This transfer function was used to design a proportional plus integral controller that demonstrated zero steady state error, conservative stability margins and adequate transient response to step changes in propellant flow rate, input voltage and temperature reference. Initial turn-on temperature overshoot from room temperature to a 650 C setpoint was 80 C. In addition, EMI was alleviated by reducing heater dI/dt and dV/dt using a simple diode-inductor-capacitor network. Based on limited initial tests, thruster preheat with no propellant flow was necessary to achieve stable system operation during startup. Breadboard power efficiency was 99 percent at 1 kW, and component mass was 0.4 kg excluding the power loss and mass of an input filter required for spacecraft integration.

Gruber, Robert P.↗

NASA NTRS1988

dc power control for a liquid-fed resistojet

Gruber, Robert P.↗

NASA NTRS1980

Space shuttle main engine digital controller

The controller provides responsive control of engine thrust and mixture ratio through the digital computer in the controller, updating the instructions to the engine control elements 50 times per second (every 20 milliseconds). Additionally, precise engine performance is achieved through closed loop control, utilizing 16 bit computation, 10 bit input/output resolution, and self calibrating analog-to-digital conversion. Engine reliability is enhanced by a dual redundant control system that allows normal operation after the first failure and a fail-safe shutdown after a second failure. The digital computer is programmable, allowing modification of engine control equations and constants by change of the stored program (software). The controller is packaged in a sealed, pressurized chassis with cooling provided by convection heat transfer through pin fins as part of the main chassis. The electronics are distributed on functional modules having special provisions for thermal and vibrational protection.

Mitchell, W. T.↗

NASA NTRS1986

The large deployable reflector: A NASA submillimeter-infrared orbiting observatory

The Large Deployable Reflector (LDR) concept is outlined. The LDR telescope is based on a 20-m diameter reflector. The primary mirror is a filled aperture made up of 84 hexagonal panels, each 2 m edge-to-edge. The panels are based on lightweight structural composite materials. The optical configuration is a four mirror two stage system. The primary mirror is passive. The active optical elements for figure control are at the quaternary mirror. The primary mirror panels are supported by a deployable PAC truss backup structure at the vertices of each hexagon. The four focal plane instruments covering the range of 30 to 1000 microns are located near the vertex of the primary mirror. Some instruments will be cooled with stored cryogens to liquid helium temperatures, others to liquid nitrogen temperatures. The spacecraft functions will be located in a resource module behind the primary mirror. The LDR will be transferred to orbit by the space transportation system and assembled and tested at the space station. It will then be boosted to an orbit of greater than or = 700 km as a free flyer.

Swanson, Paul N.↗

NASA NTRS1989

Performance evaluation of automated manufacturing systems using generalized stochastic Petri Nets

The main objective of this research is to develop a generic modeling methodology with a flexible and modular framework to aid in the design and performance evaluation of integrated manufacturing systems using a unified model. After a thorough examination of the available modeling methods, the Petri Net approach was adopted. The concurrent and asynchronous nature of manufacturing systems are easily captured by Petri Net models. Three basic modules were developed: machine, buffer, and Decision Making Unit. The machine and buffer modules are used for modeling transfer lines and production networks. The Decision Making Unit models the functions of a computer node in a complex Decision Making Unit Architecture. The underlying model is a Generalized Stochastic Petri Net (GSPN) that can be used for performance evaluation and structural analysis. GSPN's were chosen because they help manage the complexity of modeling large manufacturing systems. There is no need to enumerate all the possible states of the Markov Chain since they are automatically generated from the GSPN model.

Al-Jaar, Robert Y.↗

NASA NTRS2014

Crosstalk Cancellation for a Simultaneous Phase Shifting Interferometer

A method of minimizing fringe print-through in a phase-shifting interferometer, includes the steps of: (a) determining multiple transfer functions of pixels in the phase-shifting interferometer; (b) computing a crosstalk term for each transfer function; and (c) displaying, to a user, a phase-difference map using the crosstalk terms computed in step (b). Determining a transfer function in step (a) includes measuring intensities of a reference beam and a test beam at the pixels, and measuring an optical path difference between the reference beam and the test beam at the pixels. Computing crosstalk terms in step (b) includes computing an N-dimensional vector, where N corresponds to the number of transfer functions, and the N-dimensional vector is obtained by minimizing a variance of a modulation function in phase shifted images.

Olczak, Eugene↗

DOE OSTI2010

Response of partially premixed flames to acoustic velocity and equivalence ratio perturbations

This article describes an experimental investigation of the forced response of a swirl-stabilized partially premixed flame when it is subjected to acoustic velocity and equivalence ratio fluctuations. The flame's response is analyzed using phase-resolved CH{sup *} chemiluminescence images and flame transfer function (FTF) measurements, and compared with the response of a perfectly premixed flame under acoustic perturbations. The nonlinear response of the partially premixed flame is manifested by a partial extinction of the reaction zone, leading to rapid reduction of flame surface area. This nonlinearity, however, is observed only when the phase difference between the acoustic velocity and the equivalence ratio at the combustor inlet is close to zero. The condition, {delta}{phi}{sub {phi}}'-V'{approx}0 , indicates that reactant mixtures with high equivalence ratio impinge on the flame front with high velocity, inducing large fluctuations of the rate of heat release. It is found that the phase difference between the acoustic velocity and equivalence ratio nonuniformities is a key parameter governing the linear/nonlinear response of a partially premixed flame, and it is a function of modulation frequency, inlet velocity, fuel injection location, and fuel injector impedance. The results presented in this article will provide insight into the response of a partially premixed flame, which has not been well explored to date. (author)

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2011

Amplification of ion acoustic wave in an inhomogeneous plasma through nonlinear wave-particle interaction with drift wave turbulence

A study on the amplification of ion acoustic wave in an inhomogeneous plasma has been made on the basis of a nonlinear wave-particle interaction process called plasma maser effect. The drift wave instability, which is a universal phenomenon of an inhomogeneous confined plasma system, is found to be strongly in phase relation with thermal particles and may transfer its wave energy nonlinearly through a modulated field to ion acoustic wave. Considering a Maxwellian distribution function model for inhomogeneous plasmas under the standard local approximation, we have estimated the growth rate for ion acoustic wave, which is obtained by using the nonlinear dispersion relation. It has been found that amplification of ion acoustic wave is possible at the expense of drift wave turbulent energy. This result may be particularly important for stability of various drift modes in magnetically confined plasma as well as for transport of momentum and energy in such inhomogeneous systems.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

NASA NTRS2000

An Integrated MEMS Sensor Cluster System for Aerospace Applications

Efforts to reduce viscous drag on airfoils could results in a considerable saving for the operation of flight vehicles including those of space transportation. This reduction of viscous drag effort requires measurement and active control of boundary layer flow property on an airfoil. Measurement of viscous drag of the boundary layer flow over an airfoil with minimal flow disturbance is achievable with newly developed MEMS sensor clusters. These sensor clusters provide information that can be used to actively control actuators to obtain desired flow properties or design a vehicle to satisfy particular boundary layer flow criteria. A series of MEMS sensor clusters has been developed with a data acquisition and control module for local measurements of shear stress, pressure, and temperature on an airfoil. The sensor cluster consists of two shear stress sensors, two pressure sensors, and two temperature sensors on a surface area of 1.24 mm x 1.86 mm. Each sensor is 300 microns square and is placed on a flexible polyimide sheet. The shear stress sensor is a polysilicon hot-film resistor, which is insulated by a vacuum cavity of 200 x 200 x 2 microns. The pressure sensors are silicon piezoresistive type, and the temperature sensors are also hot film polysilicon resistors. The total size of the cluster including sensors and electrical leads is 1 Omm x 1 Omm x 0.1 mm. A typical sensitivity of shear stress sensor is 150 mV/Pascal, the pressure sensors are an absolute type with a measurement range from 9 to 36 psia with 0.8mV/V/psi sensitivity, and the temperature sensors have a measurement resolution of 0.1 degree C. The sensor clusters are interfaced to a data acquisition and control module that consists of two custom ASICs (Application Specific Integrated Circuits) and a micro-controller. The data acquisition and control module transfers data to a host PC that configures and controls a total of three sensor clusters. Functionality of the entire system has been tested in the laboratory, and preliminary test results are presented.

Kahng, Seun↗

DOE OSTI2015

Photovoltaic response in pristine WSe{sub 2} layers modulated by metal-induced surface-charge-transfer doping

We obtained photovoltaic response in pristine multilayer WSe{sub 2} by sandwiching WSe{sub 2} between top and bottom metals. In this structure, the work-function difference between the top metal and WSe{sub 2} plays a critical role in generating built-in potentials and photovoltaic responses. Our devices with Zn as top metal exhibit photo-conversion efficiencies up to 6.7% under 532 nm illumination and external quantum efficiencies in the range of 40%–83% for visible light. This work provides a method for generating photovoltaic responses in layered semiconductors without detrimental doping or exquisite heterostructures, and also advances the physics for modulating the band structures of such emerging semiconductors.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗