Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “regional models”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 1,063 records · Page 59
All sourcesNASA NTRSDOE OSTI
NASA NTRS2004

A GEO Hyperspectral Mission For Continental-Scale Carbon Cycle Observations

For both terrestrial and ocean carbon cycle science objectives, a hyperspectral geostationary sensor should enable the development of new remote sensing measurements for important but as yet unobservable variables, and with the overall goal of linking both terrestrial and ocean carbon cycle processes to climate variability. For terrestrial research, accurate estimates of carbon, water and energy (CWE) exchange between the terrestrial biosphere and atmosphere are needed to identify the geographical locations of carbon sources/sinks and to improve regional climate models and global climate change assessments. It is an enormous challenge to estimate CWE exchange from the infrequent temporal coverage provided by most polar-orbiting satellites, and without benefit of spectral indices that capture vegetation responses to stress conditions that down-regulate photosynthesis. Physiological status can be better assessed with spectral indices based on continuous, narrow (5 nm) bands, as can seasonal and annual terrestrial productivity. For coastal and ocean constituents, narrow-band observations in the ultraviolet and visible are essential to investigate the variability, dynamics and biogeochemical cycles of the world s coastal and open ocean regions, which will in turn help in measuring ocean productivity and predicting the variability of Ocean carbon uptake and its role in climate change scenarios. The GSFC Carbon Team has been pursuing a geostationary hyperspectral instrument, which would revolutionize our knowledge of biological processes on land, in the ocean, and along the coast by providing multiple, diurnal coverage. Preliminary studies in Goddard's Instrument Synthesis and Analysis Laboratory (ISAL) indicate that we can meet many of our science requirements: full spectral coverage (360-1000 nm); narrow bandwidths (5-10 nm); adequate ground resolution (100-200 m); and continental-scale coverage 4-6 times per day; all the while achieving a signal to noise ratio of between 500 and 1000 to 1. However, an innovative and bold focal plane design and a large mirror (1.8 meter diameter) would be required. The development of our science requirements and the results of the initial design study will be presented as well as our most recent technological developments.

Gervin, Janette C.↗
NASA NTRS2023

The F-CHROMA Grid of 1D RADYN Flare Models

Context. Solar flares are the result of the sudden release of magnetic energy in the corona. Much of this energy goes into accelerating charged particles to high velocity. These particles travel along the magnetic field and the energy is dissipated when the density gets high enough, primarily in the solar chromosphere. Modelling this region is difficult because the radiation energy balance is dominated by strong, optically thick spectral lines. Aims. Our aim is to provide the community with realistic simulations of a flaring loop with an emphasis on the detailed treatment of the chromospheric energy balance. This will enable a detailed comparison of existing and upcoming observations with synthetic observables from the simulations, thereby elucidating the complex interactions in a flaring chromosphere. Methods. We used the 1D radiation hydrodynamics code RADYN to perform simulations of the effect of a beam of electrons injected at the apex of a solar coronal loop. A grid of models was produced, varying the total energy input, the steepness, and low-energy cutoff of the beam energy spectrum. Results. The full simulation results for a grid of models are made available online. Some general properties of the simulations are discussed.

hydrodynamics↗
NASA NTRS1976

An experimental and computational investigation of the flow field about a transonic airfoil in supercritical flow with turbulent boundary-layer separation

A combined experimental and computational research program is described for testing and guiding turbulence modeling within regions of separation induced by shock waves incident in turbulent boundary layers. Specifically, studies are made of the separated flow the rear portion of an 18%-thick circular-arc airfoil at zero angle of attack in high Reynolds number supercritical flow. The measurements include distributions of surface static pressure and local skin friction. The instruments employed include highfrequency response pressure cells and a large array of surface hot-wire skin-friction gages. Computations at the experimental flow conditions are made using time-dependent solutions of ensemble-averaged Navier-Stokes equations, plus additional equations for the turbulence modeling.

Rubesin, M. W.↗
NASA NTRS1991

On open and closed field line regions in Tsyganenko's field model and their possible associations with horse collar auroras

The boundary between open and closed field lines is investigated in the empirical Tsyganenko (1987) magnetic field model. All field lines extending to distances beyond -70 R(E), the tailward velocity limit of the Tsyganenko model are defined as open, while all other field lines, which cross the equatorial plane earthward of -70 R(E) and are connected with the earth at both ends, are assumed closed. It is found that this boundary at the surface of the earth, identified as the polar cap boundary, can exhibit the arrowhead shape, pointed toward the sun, which is found in horse collar auroras. For increasing activity levels, the polar cap increases in area and becomes rounder, so that the arrowhead shape is less pronounced. The presence of a net B(y) component can also lead to considerable rounding of the open flux region. The arrowhead shape is found to be closely associated with the increase of B(z) from the midnight region to the flanks of the tail, consistent with a similar increase of the plasma sheet thickness.

Birn, J.↗
NASA NTRS1984

Ultraviolet and X-ray observations of active galactic nuclei: Constraints on models of the broad emission line region

Many active galactic nuclei, in particular quasars and Seyfert I's, are characterized by strong, broad emission lines from permitted transitions in abundant elements. In the simplest models, these lines ofriginate in clouds located at some characteristic distance from the central ionizing source in a quasi-spherical distribution. Ultraviolet and X-ray spectroscopic data gathered from the International Ultraviolet Explorer (IUE), HEAO 1, and HEAO 2 are utilized herein to further define and refine the photoionization models of the broad emission line region (BLR) of these galactic nuclei. Parameters including X-ray spectra, X-ray absorption, ultraviolet spectra, hydrogen cloud geometry, cosmic dust, cloud metallicity, and continuous spectra are considered. The luminosity of galactic nuclei is also discussed.

Mushotzky, R. F.↗
DOE OSTI2022

The substantial role of May soil temperature over Central Asia for summer surface air temperature variation and prediction over Northeastern China

The slowly varying soil temperature can exert local and nonlocal influences on regional climate system, and may thus provide a critical source of subseasonal-to-seasonal climate prediction. In this study, we identify that soil temperature in May over the key region of Central Asia (42 °N–50 °N, 62 °E–80 °E, KRCA) from Noah, Mosaic, CLM and ERA-interim datasets is closely linked to variations of the surface air temperature, daily maximum temperature and hot days over Northeastern China in summer (June-July-August), with correlation coefficients of regional average detrended time series ranging from 0.42 to 0.54, and all significant at the 99% confidence level for the period of 1979-2018. The possible physical mechanism behind the substantial downstream impacts of soil temperature over Central Asia are explored via diagnostical analysis combined with regional climate model experiments. Warmer soil temperature in May over the KRCA tends to cause positive anomalies of geopotential height in summer over Northeastern China through the Rossby wave propagation, and associated stronger subsidence warming, less cloud cover, more solar radiation reaching the surface, higher planetary boundary layer, and stronger thermal advection at 850 hPa, which provide favorable conditions for warmer surface air temperature particularly in the daytime as well as more hot days. Here this study further reveals that soil temperature over Central Asia in May makes important contribution to prediction of summer surface air temperature, daily maximum temperature and hot days over Northeastern China in terms of regional average time series and spatial patterns. Our findings highlight the previously-unknown substantial role of antecedent soil temperature condition over Central Asia for summer surface air temperature variation and prediction over Northeastern China.

54 ENVIRONMENTAL SCIENCES↗
NASA NTRS1976

An experimental and computational investigation of the flow field about a transonic airfoil in supercritical flow with turbulent boundary-layer separation

A combined experimental and computational research program for testing and guiding turbulence modeling within regions of separation induced by shock waves incident on turbulent boundary layers is described. Specifically, studies are made of the separated flow over the rear portion of an 18%-thick circular-arc airfoil at zero angle of attack in high Reynolds number supercritical flow. The measurements include distributions of surface static pressure and local skin friction. The instruments employed include high-frequency response pressure cells and a large array of surface hot-wire skin-friction gages. Computations at the experimental flow conditions are made using time-dependent solutions of ensemble-averaged Navier-Stokes equations, plus additional equations for the turbulence modeling.

Rubesin, M. W.↗
NASA NTRS2010

Investigation of Long-Term Impacts of Urbanization when Considering Global Warming for a Coastal Tropical Region

The overachieving goal of this project is to gain a better understanding of the climate impacts caused by the combined effects of land cover and land use (LCLU) changes and increasing global concentrations of green house gases (GHG) in tropical coastal areas, regions where global, regional and local climate phenomena converge, taking as the test case the densely populated northeast region of the Caribbean island of Puerto Rico. The research uses an integrated approach of high-resolution remote sensing information linked to a high resolution Regional Atmospheric Modeling System (RAMS), which was employed to perform ensembles of climate simulations (combining 2-LCLU and 2-GHG concentration scenarios). Reconstructed agricultural maps are used to define past LCLU, and combined with reconstructed sea surface temperatures (SST) for the same period form the PAST climate scenario (1951-1956); while the PRESENT scenario (2000-2004) was additionally supported by high resolution remote sensing data (10-m-res). The climate reconstruction approach is validated with available observed climate data from surface weather stations for both periods of time simulated. The selection of the past and present climate scenarios considers large-scale biases (i.e. ENSO/NAO) as reflected in the region of interest. Direct and cross comparison of the results is allowing quantifying single, combined, and competitive effects. Results indicate that global GHG have dominant effects on minimum temperatures (following regional tendencies), while urban sprawl dominates maximum temperatures. To further investigate impacts of land use the Bowen Ratio and the thermal response number (TRN) are analyzed. The Bowen ratio indicates that forestation of past agricultural high areas have an overwhelmingly mitigation effect on increasing temperatures observed in different LCLU scenarios, but when abandoned agricultural lands are located in plains, the resulting shrub/grass lands produce higher surface temperatures. The TRN (J/m^2/degC) is a surface property defined as the ratio of the surface net radiation to the rate of change in surface temperature, expresses how those fluxes are reacting to radiant energy inputs. Natural vegetated surfaces have a greater TRN than urban and barren surfaces because the net radiation processed by them is mostly used for latent heat and thermal storage heat rather than sensible heat (heating the air). Significant changes in TRN were observed in the metropolitan area of San Juan for the two analyzed periods reflecting a reduction of this variable in the present from the past consistent with increasing in thermal mass, or intense urbanization.

Gonalez, Jorge E.↗
NASA NTRS2007

The Impact of Atmospheric InfraRed Sounder (AIRS) Profiles on Short-term Weather Forecasts

The Atmospheric Infrared Sounder (AIRS), together with the Advanced Microwave Sounding Unit (AMSU), represents one of the most advanced spacebased atmospheric sounding systems. The combined AlRS/AMSU system provides radiance measurements used to retrieve temperature profiles with an accuracy of 1 K over 1 km layers under both clear and partly cloudy conditions, while the accuracy of the derived humidity profiles is 15% in 2 km layers. Critical to the successful use of AIRS profiles for weather and climate studies is the use of profile quality indicators and error estimates provided with each profile Aside form monitoring changes in Earth's climate, one of the objectives of AIRS is to provide sounding information of sufficient accuracy such that the assimilation of the new observations, especially in data sparse region, will lead to an improvement in weather forecasts. The purpose of this paper is to describe a procedure to optimally assimilate highresolution AIRS profile data in a regional analysis/forecast model. The paper will focus on the impact of AIRS profiles on a rapidly developing east coast storm and will also discuss preliminary results for a 30-day forecast period, simulating a quasi-operation environment. Temperature and moisture profiles were obtained from the prototype version 5.0 EOS science team retrieval algorithm which includes explicit error information for each profile. The error profile information was used to select the highest quality temperature and moisture data for every profile location and pressure level for assimilation into the ARPS Data Analysis System (ADAS). The AIRS-enhanced analyses were used as initial fields for the Weather Research and Forecast (WRF) system used by the SPORT project for regional weather forecast studies. The ADASWRF system will be run on CONUS domain with an emphasis on the east coast. The preliminary assessment of the impact of the AIRS profiles will focus on quality control issues associated with AIRS, intelligent use of the quality indicators, and forecast verification.

Chou, Shih-Hung↗
NASA NTRS2003

The Shock Structure of Supernova Remnant IC443

We present and discuss ISO observations of IC443, a supernova remnant interacting with a molecular cloud. An SWS spectrum centered on molecular hydrogen clump R10E (RA(2000) = 6 17 7.6, Decl(2000) = 22 25 34.6) is dominated by strong [SiII] (34 microns) emission and the pure rotational transitions of molecular hydrogen ranging from 0-0 S(1) to 0-0 S(13). Fits to these H$-2$ lines imply a large column (approx. 7E19 cm$ {-2)$) of warm (T approx. 700 K) gas and an ortho/para ratio for hydrogen near 3. LWS Fabry-Perot spectra of [OI] (63 microns) and [CII] (158 microns) at positions R10E and C (RA(2000) = 6 17 42.8, Decl(2000) = 22 21 38.1) find broad (approx. 75 km/s), blue-shifted (-40 km/s) line profiles; their similarity strongly suggests a common, shock-generated origin for these two lines. The surprisingly large [CII]/[OI] ratio (approx. 0.1 to 0.2) confirms previous observations with the Kuiper Airborne Observatory. These [CII] and [OI] line intensities, the [SiII] intensity (above), and LWS grating measurements of OH (119 microns) and [OI] (145 microns) are all readily fit by a single, fast J-shock model. Although the [OI] (63) emission can alternatively be produced by a slow C-shock, this ensemble of lines can not be produced by such a shock and provides strong evidence for the existence of a J-shock. A 24-arcmin strip map shows that this far-infrared line emission is spatially correlated with the H$-2$ 1-0 S(1) emission, which most likely arises in an associated C-shock. In addition to this spatially correlated shock emission, the strip map identifies extended [CII] and [OI] emission with a significantly larger line ratio (approx. 0.6); this 'background' component is compared with current J-shock, C-shock, photo-dissociation region (PDR), and X-ray dissociation region (XDR) models in an effort to explain its origin.

Haas, Michael R.↗
DOE OSTI2020

Ionization wave propagation in a He plasma jet in a controlled gas environment

Characterizing ionization wave propagation in low temperature plasma jets is critical to predicting production of reactive species and plasma–surface interactions for biomedical applications and surface functionalization. In this work, results from optical emission and laser induced fluorescence measurements of the ionization wave in a He plasma jet operating in a controlled gas environment are discussed and used for comparison with numerical modeling. Additionally, the ionization wave was observed using ICCD (Intensified Charge Coupled Device) imaging and characterized by time and spatially resolved electron density measurements using laser-collision-induced fluorescence. The plasma jet was initially characterized using pure He (nominally at 200 Torr), while varying pressure and voltage. When operating in pure He, the ionization wave broadly expands exiting the plasma tube. Increasing the operating pressure reduces the speed and isotropic expansion of the ionization wave. Furthermore, the jet operated with a humid He shroud was also studied. The humid He shroud results in the electron density increasing and having an annular profile due to the lower ionization potential of H2O compared to He and localized photoionization in the mixing region. Numerical modeling highlighted the importance of resonance radiation emitted by excited states of He, photoelectron emission from the quartz tube, and the kinetic behavior of the electrons produced by photoionization ahead of the ionization front.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS1983

An analytic solution for the response of the neutral atmosphere to the high-latitude convection pattern

The analytic solutions to a two-dimensional, shallow-water model of the high-latitude thermosphere are developed. The equations are a linearized representation of the response of the neutral atmosphere to the momentum source due to the plasma convection pattern. The obtained results show how the neutral winds depend on the Pedersen and Hall ion drag coefficients and the horizontal wave number. The response depends on the dimensionless scale as it appears in the product of the Rossby radius of deformation and the wave number. The flow pattern is shifted in local time from the plasma flow pattern by an amount that depends on the average electron density. At the largest scales there is a 180 deg phase shift between the rotational flow components in the E and F regions. The model applies to quiet magnetic conditions and below 200 km of altitude.

Mikkelsen, I. S.↗
DOE OSTI2024

Machine Learning-Based Identification of the Interface Regions for Coupling Local and Nonlocal Models

Local-nonlocal coupling approaches provide a means to combine the computational efficiency of local models and the accuracy of nonlocal models. However, the coupling process can be challenging, requiring expertise to identify the interface between local and nonlocal regions. Here, this study introduces a machine learning-based approach to automatically detect the regions in which the local and nonlocal models should be used. The method uses loading functions evaluated at grid points to decide the model selection at those points. Training of the networks is based on datasets provided by classes of loading functions for which reference coupling configurations are computed using accurate coupled solutions, where accuracy is measured in terms of the relative error between the solution to the coupling approach and the solution to the nonlocal model. We study two approaches that vary in data structure. The first, the full-domain input data approach, uses the entire load vector and outputs a complete label vector, performing a global classification. The second, a window-based approach, processes loads into windows and addresses the problem as a node-wise classification where each window's central point is classified individually. The classification problems are solved via deep learning algorithms based on convolutional neural networks. The performance of these approaches is studied on one-dimensional numerical examples using F1-scores and accuracy metrics. Notably, the windowing approach achieves an accuracy of 0.96 and an F1-score of 0.97, highlighting its potential to automate coupling processes effectively and enhance computational efficiency in material science applications.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS2004

A LEO Hyperspectral Mission Implementation for Global Carbon Cycle Observations

For both terrestrial and ocean carbon cycle science objectives, high resolution (less than l0 nm) imaging spectrometers capable of acquiring multiple regional to global scale observations per day should enable the development of new remote sensing measurements for important but as yet unobservable variables, with the overall goal of linking both terrestrial and ocean carbon cycle processes to climate variability. For terrestrial research, accurate estimates of carbon, water and energy (CWE) exchange between the terrestrial biosphere and atmosphere a needed to id- the geographical locations and temporal dynamics of carbon sources/sinks and to improve regional climate models and climate change assessments. It is an enormous challenge to estimate CWE exchange from the infrequent temporal coverage and sparse spectral information provided by most single polar-orbiting, earth-looking satellite. The available satellite observations lack a sufficient number of well-placed narrow bands from which to derive spectral indices that capture vegetation responses to stress conditions associated with down-regulation of photosynthesis. Physiological status can best be assessed with spectral indices based on continuous, narrow bands in the visible/near infrared spectra, as can seasonal and annual terrestrial productivity. For coastal and ocean constituents, narrow-band observations in the ultraviolet and visible are essential to investigate the variability, dynamics and biogeochemical cycles of the world's coastal and open ocean regions, which will in turn help in measuring ocean productivity and predicting the variability of ocean carbon uptake and its role in climate change.

Gervin, Janette C.↗
DOE OSTI2020

Evaluation of historical CMIP6 model simulations of extreme precipitation over contiguous US regions

Simulated historical precipitation is evaluated for Coupled Model Intercomparison Project Phase 6 (CMIP6) models using precipitation indices defined by the Expert Team on Climate Change Detection and Indices. The model indices are evaluated against corresponding indices from the CPC unified gauge-based analyses of precipitation over seven geographical regions across the contiguous US (CONUS). The regions assessed match those in recent US National Climate Assessment Reports. To estimate observational uncertainty, precipitation indices for three other observational datasets (HadEx2, Livneh and PRISM) are evaluated against the CPC analyses. Both the moderate and extreme mean precipitation intensities are overestimated over the western CONUS and underestimated in the areas of the Central Great Plains (CGP) in most CMIP6 models tested. Most CMIP6 models overestimate the mean and variability of wet spell durations and underestimate the mean and variability of dry spell durations across the CONUS. Biases in interannual variability of most of the indices have similar patterns to those in corresponding mean biases. The median and interquartile model spreads in CMIP6 model biases are clearly smaller than those in CMIP5 model biases for wet spell durations. Multimodel medians of CMIP6 (CMIP6-MMM) and CMIP5 (CMIP5-MMM) have similar biases in climatology and variability but biases tend to be smaller in CMIP6-MMM. Depending on the index, extreme precipitation is slightly better in parts of the eastern half of the CONUS in CMIP6-MMM, otherwise, the biases in climatology and variability are similar to CMIP5-MMM. CMIP6-MMM performs better than individual models and even observational datasets in some cases. Differences between observational datasets for most indices are comparable to the CMIP6 interquartile model spread. The better-performing observational and model datasets are different in different parts of the CONUS.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Exascale-capable cellular automaton for nucleation and grain growth

This model is a cellular automata-based algorithm used to predict grain-scale microstructure development. Nucleation and growth of existing grains are considered in an initially liquid domain, where the temperature field evolution is either driven through heat transport simulation data or a frozen temperature approximation (i.e., a constant cooling rate and a fixed thermal gradient). The growth of grains is based on the decentered octahedron algorithm published by Gandin and Rappaz (https://doi.org/10.1016/S1359-6454(96)00303-5), where the grain envelopes are tracked as approximations of the evolving dendritic growth front. The input heat transport data, which can come from simulation of an arbitrary processing technique, consists of coordinates and times at which said coordinates fall below the liquidus and solidus temperatures for the final time. As a result, only the final solidification of a given region is modeled (no remelting). The code is designed to be compatible with pre-Exascale architectures, and uses MPI and the Kokkos library to decompose the computational domain and offload solidification calculations to GPUs.

Rolchigo, MatthewR.↗
DOE OSTI2024

Dependencies of Simulated Convective Cell and System Growth Biases on Atmospheric Instability and Model Resolution

Abstract This study evaluates convective cell properties and their relationships with convective and stratiform rainfall within a season‐long convection‐permitting weather research and forecasting simulation over central Argentina using radar, satellite, and radiosonde measurements from the RELAMPAGO‐CACTI field campaign. The simulation slightly underestimates radar‐estimated rainfall over the ∼3.5‐month evaluation period but underestimates stratiform rainfall by 46% and overestimates convective rainfall by 43%. As convective available potential energy (CAPE) increases, the convective rainfall overestimation decreases, but the stratiform rainfall underestimation increases such that the contribution of convective to total rainfall remains constantly high biased by ∼26%. Overestimated convective rainfall arises from the simulation generating 2.6 times more precipitating convective cells (14,299) than observed by radar (5,662) despite similar observed and simulated cell growth processes, with relatively wide cells contributing mostly to excessive convective rainfall. Relatively shallow cells, typically reaching heights of 4–7 km, contribute most to the cell number bias. This cell number bias increases as CAPE decreases, potentially because cells and their updrafts become narrower and more under‐resolved as CAPE decreases. The gross overproduction of precipitating shallow cells leads to overly efficient precipitation and inadequate detrainment of ice aloft, thereby diminishing the formation of robust stratiform rainfall regions. Decreasing model horizontal grid spacing from 3 to 1 or 0.333 km for low (<300 J kg −1 ) and high CAPE (>1,000 J kg −1 ) cases results in minimal change to cell number, depth, and convective‐to‐stratiform partitioning biases. This suggests that improving prediction of these convective properties depends on factors beyond solely increasing model resolution.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Isotherm Modeling and Techno-Economic Analysis of Contactor Technologies for New Tetraamine-Appended MOF for NGCC Applications

Recently, a family of tetraamine-functionalized metal-organic frameworks (MOF) has been reported as promising sorbent materials for capturing CO2 from flue gas conditions relevant to natural gas combined cycle (NGCC) applications. The main advantages of these materials are their two-step cooperative CO2 adsorption, which gives rise to unusual two step-shaped CO2 adsorption profiles and their high thermal stability. This work presents the modelling of the two-transition isotherm of the tetraamine-appended MOF, N,N'-bis(3-aminopropyl)-1,4-diaminobutane (3-4-3)-appended Mg2(dobpdc), and the techno-economic analysis (TEA) of carbon capture processes utilizing this sorbent. Due to the unusual isotherm shapes of the experimental CO2 adsorption data for tetraamine-appended Mg2(dobpdc) and the strong nonlinearity of CO2 loading with respect to temperature and pressure, we tested two different models which use logistic functions for representing the different isotherm behaviors in the different pressure ranges. The first model uses the quadratic isotherm model in the low-pressure region, the Langmuir isotherm model in the middle pressure range, and the dual site Langmuir isotherm model in the high-pressure range. To model the transition between regions we used the arctangent functions independent of temperature and the thermal effect was accounted by using the Clausius-Clapeyron relation]. The second model is an extension of the weighted dual-site Langmuir isotherm model presented by Hughes et al.. In this extended model, the dual-site Langmuir isotherm is employed in the three transition regions, using temperature-dependent logistic functions to activate or deactivate the isotherm model in the low, middle, and high-pressure ranges. Both models fit the experimental data quite well with root mean squared errors (RMSE’s) of 0.41 and 0.17 for model 1 and model 2, respectively. Since model 2 resulted in a lower RMSE, it was leveraged for the development of the gas/solid contactor models used by the TEA. Specifically, two different contactor models, an axial-flow fixed bed and moving bed contactor, were developed as part of this work. These models are dynamic, pressure-driven, and consist of mass, energy, and momentum conservation equations. A kinetic model was also developed by performing parameter estimation using experimental fixed bed breakthrough data. These models are then used to simulate CO2 capture processes from the flue gas generated from a ~600 gross MW NGCC power plant. A cost model was developed which considers the capital cost of the reactors and the significant operating costs such as steam and electricity. Using NETL’s Framework for the Optimization and Quantification of Uncertainty of Uncertainty and Surrogates tool (FOQUS), which has the capability of linking models built using numerous modelling platforms with derivative-free optimization solvers, a techno-economic optimization of the carbon capture processes was performed which minimizes the cost of capture.

Caballero, Daison↗