Modeling Diffusion of Impurities in Molybdenum Thin Films as a Function of Substrate Temperature
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Energy & Fuels↗
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Improving Common PV Module Temperature Models by Incorporating Radiative Losses to the Sky
PV module operating temperature is the second-most important factor influencing PV system yield–after irradiance–and a substantial contributor to uncertainty in energy system yield predictions. Models commonly used to predict operating temperature in system simulations are based on a simplified energy balance that lumps together different heat loss mechanisms–including radiation–and assumes an overall linear behavior. Radiative heat loss to the sky is usually substantial, but modeling it accurately requires additional information about down-welling long-wave radiation or sky temperature and increases the complexity of temperature model equations. In this work we show how radiative losses to the sky can be separated into two parts to improve the accuracy of modeling without additional complexity. We also predict and demonstrate the variation of these losses at different tilt angles and show that the effective view factor is reduced by the non- isotropic distribution of down-welling long-wave radiation. Finally, we demonstrate substantial reduction in bias (MBE) and scatter (RMSE) when the new radiative loss term is added to the Faiman model using one year of measurements at Sandia National Labs.
14 SOLAR ENERGY↗
Interpretation of thermoreflectance measurements with a two-temperature model including non-surface heat deposition
We develop a solution to the two-temperature diffusion equation in axisymmetric cylindrical coordinates to model heat transport in thermoreflectance experiments. Our solution builds upon prior solutions that account for two-channel diffusion in each layer of an N-layered geometry, but adds the ability to deposit heat at any location within each layer. We use this solution to account for non-surface heating in the transducer layer of thermoreflectance experiments that challenge the timescales of electron-phonon coupling. A sensitivity analysis is performed to identify important parameters in the solution and to establish a guideline for when to use the two-temperature model to interpret thermoreflectance data. We then fit broadband frequency domain thermoreflectance (BB-FDTR) measurements of SiO{sub 2} and platinum at a temperature of 300 K with our two-temperature solution to parameterize the gold/chromium transducer layer. We then refit BB-FDTR measurements of silicon and find that accounting for non-equilibrium between electrons and phonons in the gold layer does lessen the previously observed heating frequency dependence reported in Regner et al. [Nat. Commun. 4, 1640 (2013)] but does not completely eliminate it. We perform BB-FDTR experiments on silicon with an aluminum transducer and find limited heating frequency dependence, in agreement with time domain thermoreflectance results. We hypothesize that the discrepancy between thermoreflectance measurements with different transducers results in part from spectrally dependent phonon transmission at the transducer/silicon interface.
71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
X-band atmospheric noise temperature statistics at Goldstone, DSS 13, 1979 and 1980, and clear air noise temperature models for Goldstone
Superhigh frequency (X band) noise temperature data are presented which illustrate the noise temperature increase above quiescent baseline for the years 1979 and 1980. Clear air models are also given which shows the seasonal noise temperature effects of changing surface water vapor densities for a particular atmospheric model.
Slobin, S. D.↗
Granular Temperature Modeling with Large-Scale CFD-DEM Data
The granular temperature is a measure of solids-phase fluctuating kinetic energy in particle-laden gas-solid flows. This report focuses on reduced-order models of granular temperature in triply-periodic cluster induced turbulent flow. The granular temperature data was generated by post-processing large-scale CFD-DEM simulations that were carried out as part of an ALCC awarded study. The algebraic model of Tang et al, originally fit to DNS data, was found to be amenable to the present data. The results of several regression analyses are presented building on the original expression. This work was performed in part through the National Nuclear Security Administration (NNSA) Minority Serving Institutions Internship Program (MSIIP).
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Foundational Dataset for Developing Large-Sample Stream Temperature Models in the Conterminous United States
This dataset provides inputs, evaluation results, and trained weights from a large-sample Long Short-Term Memory (LSTM) model designed to predict daily stream temperatures across unregulated river reaches in the conterminous United States (CONUS). It includes dynamic meteorological and hydrologic forcings, static physiographic attributes, and model outputs from cross-validation experiments spanning 300 basins. It supports reproducible modeling, direct application for new basins, and provides data suitable for integration with reservoir and river simulations under current and future climates. It contains two .zip files described below · RQ-AI_runs.zip: Model outputs from 10-fold cross-validation experiments, including observed and predicted daily stream temperatures, along with test performance metrics for water years 2017–2019. Two versions are included: 1. Model trained and validated using subbasin-area weighted dynamic features. 2. Model trained and validated using whole-basin area weighted dynamic features. · RQ-AI_inputs.zip: Collection of all formatted dynamic and static predictor datasets (meteorological, hydrologic, and physiographic features) used in model training and analysis. Detailed instructions and data structure is held at the following GitLab repository: https://code.ornl.gov/tempwise/training.
Gomez-Velez, Jesus [Oak Ridge National Laboratory ↗
Non-stationary Return Levels of CMIP5 Multi-model Temperature Extremes
The objective of this study is to evaluate to what extent the CMIP5 climate model simulations of the climate of the twentieth century can represent observed warm monthly temperature extremes under a changing environment. The biases and spatial patterns of 2-, 10-, 25-, 50- and 100-year return levels of the annual maxima of monthly mean temperature (hereafter, annual temperature maxima) from CMIP5 simulations are compared with those of Climatic Research Unit (CRU) observational data considered under a non-stationary assumption. The results show that CMIP5 climate models collectively underestimate the mean annual maxima over arid and semi-arid regions that are most subject to severe heat waves and droughts. Furthermore, the results indicate that most climate models tend to underestimate the historical annual temperature maxima over the United States and Greenland, while generally disagreeing in their simulations over cold regions. Return level analysis shows that with respect to the spatial patterns of the annual temperature maxima, there are good agreements between the CRU observations and most CMIP5 simulations. However, the magnitudes of the simulated annual temperature maxima differ substantially across individual models. Discrepancies are generally larger over higher latitudes and cold regions.
54 ENVIRONMENTAL SCIENCES↗
Development and Experimental Optimization of High-Temperature Modeling Tools and Methods for Concentrated Solar Power Particle - Systems
A novel, open-source radiative modeling toolset was developed to extend the functionality of particle-based modeling software (e.g. discrete element method (DEM)) to environmental conditions relevant to concentrated solar power applications. This toolset was optimized for deployment on desktop workstations instead of high-performance computing systems, to render such tools more accessible to the research community. Both particle-based modeling and radiative exchange modeling are computationally expensive and often require specialized programming expertise, making these methods cumbersome to use. Recent developments in DEM software by DCS Computing have greatly reduced these challenges, providing a graphical-user-interface based platform and modeling optimization for desktop workstations, HPCs, and cloud computing. The University of Dayton leveraged the experience of DCS Computing in developing a user-friendly, open-source radiative heat transfer expansion for DEM modeling. The University of Dayton DEM+ radiative modeling toolset was developed using a combination of fundamental experimental measurements, modeling, and simplified flow experiments over a range of temperatures and flow conditions. The toolset provides researchers with access to multiple radiative models including an accelerated Monte-Carlo Ray Tracing (application agnostic, highly computationally expensive), an expanded database of distance-based approximations (application limited, computationally light), and a weighted blending of the two methods capable of achieving over 90% reduction in computation time with equivalent accuracy compared to Monte-Carlo Ray Tracing. Through a graphical user interface, users can customize the radiative models to match their desired accuracy and available computational resources, improving access to particle based modeling for the research community. Ceramic sintered bauxite proppants were used in modeling and experimentally as a baseline. Both the radiative heat transfer and flow properties for particulate systems were investigated at elevated temperatures up to 800 °C. The major accomplishments for this work include a verified, open-source radiative modeling toolset to be distributed amongst the research community and the fabrication of three small-scale test facilities to investigate particle behavior and tune DEM flow properties for operation up to 800 °C. The findings have been shared with the research community via conference modeling workshops, deployment of the tools in DCS Computing Aspherix®, and open-source access to the developed radiative modeling tool. The development of next-generation CSP facilities and thermal energy storage systems based on ceramic particles requires providing access to computationally efficient and accurate modeling tools. Particles will experience a wide range of environments (20-800 °C) and handling conditions (dilute curtains or dense packing), requiring specially designed and optimized equipment. Optimizing solid particle physics models and establishing best-practices for particle modeling in CSP environments will assist researchers with designing optimized equipment, accelerating the deployment of more economically-competitive CSP facilities.
14 SOLAR ENERGY↗
Channel Temperature Model for Microwave AlGaN/GaN HEMTs on SiC and Sapphire MMICs in High Power, High Efficiency SSPAs
A key parameter in the design trade-offs made during AlGaN/GaN HEMTs development for microwave power amplifiers is the channel temperature. An accurate determination can, in general, only be found using detailed software; however, a quick estimate is always helpful, as it speeds up the design cycle. This paper gives a simple technique to estimate the channel temperature of a generic microwave AlGaN/GaN HEMT on SiC or Sapphire, while incorporating the temperature dependence of the thermal conductivity. The procedure is validated by comparing its predictions with the experimentally measured temperatures in microwave devices presented in three recently published articles. The model predicts the temperature to within 5 to 10 percent of the true average channel temperature. The calculation strategy is extended to determine device temperature in power combining MMICs for solid-state power amplifiers (SSPAs).
Freeman, Jon C.↗
Effects of two-temperature model on cascade evolution in Ni and NiFe
We perform molecular dynamics simulations of Ni ion cascades in Ni and equiatomic NiFe under the following conditions: (a) classical molecular dynamics (MD) simulations without consideration of electronic energy loss, (b) classical MD simulations with the electronic stopping included, and (c) using the coupled two-temperature MD (2T-MD) model that incorporates both the electronic stopping and the electron-phonon interactions. Our results indicate that the electronic effects are more profound in the higher-energy cascades, and that the 2T-MD model results in a smaller amount of surviving damage and smaller defect clusters, while less damage is produced in NiFe than in Ni.
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
Boundary conditions at the walls with thermionic electron emission in two temperature modeling of “thermal” plasmas
In this paper, we propose new boundary conditions for the electric potential, the electron energy equation, and the energy equation for heavy particles (ions and neutrals) at the hot walls with thermionic electron emission for two-temperature thermal arc models. The derived boundary conditions assume that the walls are made from refractory metals and, consequently, the erosion of the wall is small and can be neglected. In these boundary conditions, the plasma sheath formed at the electrode is viewed as the interface between the plasma and the wall. The derived boundary conditions allow the calculation of the heat flux to the walls from the plasma. This allows the calculation of the thermionic electron current that makes the model of electrode-plasma interaction self-consistent.
70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
Implementation of the new electron temperature model in IRI
Since the first edition of IRI in 1978, considerable efforts have been directed towards an improved and refined electron temperature description. Finally, a new empirical model was presented at the COSPAR meeting at Graz, Austria, in 1984 (Bilitza et al.). Based mainly on satellite data it highlights a more detailed diurnal, seasonal, and altitudinal variation. The implementation of this model into the IRI framework is described. A first comparison with incoherent scatter measurements indicates the improved diurnal and seasonal performance of the model.
Bilitza, D.↗
Optimizing the Orientation of Solar Photovoltaic Systems Considering the Effects of Irradiation and Cell Temperature Models with Dust Accumulation
To cope with the growing installation capacities of solar photovoltaic (PV) systems in desert areas, it is necessary to revisit the energy production models and the optimal angles of PV panels given the significant impacts of ambient temperature, wind speed, dust accumulation, and cleaning frequency. In this study, these four factors are examined for four PV technologies (polycrystalline, microcrystalline, monocrystalline, and thin-film) at three cities in Jordan, Egypt, and Tunisia using precise ground-level meteo-solar measurements. Different models are compared to estimate the diffuse irradiance, as well as account for the effects of operating temperature, wind speed, and dust accumulation on energy production and optimal tilt and azimuth angles of the panels. The results reveal 1.5 % higher energy production estimates using the isotropic model, compared to the anisotropic model in the summer months. Considering the cooling effect of wind speed decreases the operating cell temperature drops by up to 7.05 % for thin film panels. The annually produced energy decreases by 24 % when the panels are cleaned bi-monthly. When the dust accumulation rate doubles, the energy production decreases by ~10 % for all studied cases. Also, the variations in optimal tilt and azimuth angles with dust accumulation rate are within ~3.0 degrees .
14 SOLAR ENERGY↗
Geostationary Operational Environmental Satellite (GOES) Gyro Temperature Model
The geostationary Operational Environmental Satellite (GOES) 1/M series of spacecraft are geostationary weather satellites that use the latest in weather imaging technology. The inertial reference unit package onboard consists of three gyroscopes measuring angular velocity along each of the spacecraft's body axes. This digital integrating rate assembly (DIRA) is calibrated and used to maintain spacecraft attitude during orbital delta-V maneuvers. During the early orbit support of GOES-8 (April 1994), the gyro drift rate biases exhibited a large dependency on gyro temperature. This complicated the calibration and introduced errors into the attitude during delta-V maneuvers. Following GOES-8, a model of the DIRA temperature and drift rate bias variation was developed for GOES-9 (May 1995). This model was used to project a value of the DIRA bias to use during the orbital delta-V maneuvers based on the bias change observed as the DIRA warmed up during the calibration. The model also optimizes the yaw reorientation necessary to achieve the correct delta-V pointing attitude. As a result, a higher accuracy was achieved on GOES-9 leading to more efficient delta-V maneuvers and a propellant savings. This paper summarizes the: Data observed on GOES-8 and the complications it caused in calibration; DIRA temperature/drift rate model; Application and results of the model on GOES-9 support.
Rowe, J. N.↗
A TWO-TEMPERATURE MODEL OF MAGNETIZED PROTOSTELLAR OUTFLOWS
We explore kinematics and morphologies of molecular outflows driven by young protostars using magnetohydrodynamic simulations in the context of the unified wind model of Shang et al. The model explains the observed high-velocity jet and low-velocity shell features. In this work we investigate how these characteristics are affected by the underlying temperature and magnetic field strength. We study the problem of a warm wind running into a cold ambient toroid by using a tracer field that keeps track of the wind material. While an isothermal equation of state is adopted, the effective temperature is determined locally based on the wind mass fraction. In the unified wind model, the density of the wind is cylindrically stratified and highly concentrated toward the outflow axis. Our simulations show that for a sufficiently magnetized wind, the jet identity can be well maintained even at high temperatures. However, for a high temperature wind with low magnetization, the thermal pressure of the wind gas can drive material away from the axis, making the jet less collimated as it propagates. We also study the role of the poloidal magnetic field of the toroid. It is shown that the wind-ambient interface becomes more resistant to corrugation when the poloidal field is present, and the poloidal field that bunches up within the toroid prevents the swept-up material from being compressed into a thin layer. This suggests that the ambient poloidal field may play a role in producing a smoother and thicker swept-up shell structure in the molecular outflow.
79 ASTRONOMY AND ASTROPHYSICS↗
Differentiating Hund from Mott physics in a three-band Hubbard-Hund model: Temperature dependence of spectral, transport, and thermodynamic properties
We study the interplay between Mott physics, driven by Coulomb repulsion U, and Hund physics, driven by Hund's coupling J, for a minimal model for Hund metals, the orbital-symmetric three-band Hubbard-Hund model (3HHM) for a lattice filling of 1/3. Hund-correlated metals are characterized by spin-orbital separation (SOS), a Hund's-rule-induced two-stage Kondo-type screening process, in which spin screening occurs at much lower energy scales than orbital screening. By contrast, in Mott-correlated metals, lying close to the phase boundary of a metal-insulator transition, the SOS window becomes negligibly small and the Hubbard bands are well separated. Using dynamical mean-field theory and the numerical renormalization group as real-frequency impurity solver, we identify numerous fingerprints distinguishing Hundness from Mottness in the temperature dependence of various physical quantities. Furthermore, These include ARPES-type spectra, the local self-energy, static local orbital and spin susceptibilities, resistivity, thermopower, and lattice and impurity entropies. Our detailed description of the behavior of these quantities within the context of a simple model Hamiltonian will be helpful for distinguishing Hundness from Mottness in experimental and theoretical studies of real materials.
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
First-principles effective Hamiltonian for finite-temperature modeling of nonperovskite ferroelectrics
First-principles-based effective Hamiltonian techniques have been widely employed for over three decades to investigate ferroelectricity and related phenomena in perovskite materials. These techniques offer high accuracy, transferability, compatibility with various finite-temperature algorithms, computational efficiency, and ease in incorporating interactions with external fields. They have been adapted to study diverse phenomena, ranging from topological dipole patterns in ferroelectric nanostructures to multicaloric effects. In this work, we develop an effective Hamiltonian for the nonperovskite ferroelectric HfO 2 (hafnia). Applying this methodology to explore the finite-temperature and finite-electric-field properties of ferroelectric hafnia revealed (1) exceptionally large intrinsic coercive fields, an order of magnitude higher than those observed in perovskite ferroelectrics; (2) their atomistic origin; and (3) the existence of a regime where the relationship between the coercive field and the energy barrier for polarization reversal is counterintuitive. Here, these developments could accelerate progress both in methodological advancements for simulating ferroics and in the atomistic understanding of a broad range of ferroelectrics.
Electric polarization↗
Indonesian commercial bus drum brake system temperature model
Brake system is the most significant aspect of an automobile safety. It must be able to slow the vehicle, quickly intervening and reliable under varying conditions. Commercial bus in Indonesia, which often stops suddenly and has a high initial velocity, will raise the temperature of braking significantly. From the thermal analysis it is observed that for the bus with the vehicle laden mass of 15 tons and initial velocity of 80 km/h the temperature is increasing with time and reaches the highest temperature of 270.1 °C when stops on a flat road and reaches 311.2 °C on a declination road angle, ø, 20°. These temperatures exceeded evaporation temperature of brake oil DOT 3 and DOT 4. Besides that, the magnitude of the braking temperature also potentially lowers the friction coefficient of more than 30%. The brakes are pressed repeatedly and high-g decelerations also causes brake lining wear out quickly and must be replaced every 1 month as well as the emergence of a large thermal stress which can lead to thermal cracking or thermal fatigue crack. Brake fade phenomenon that could be the cause of many buses accident in Indonesia because of the failure of the braking function. The chances of accidents will be even greater when the brake is worn and not immediately replaced which could cause hot spots as rivets attached to the brake drum and brake oil is not changed for more than 2 years that could potentially lower the evaporation temperature because of the effect hygroscopic.
42 ENGINEERING↗