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NASA NTRS2013

Improved Understanding of the Modeled QBO Using MLS Observations and MERRA Reanalysis

The Quasi-Biennial Oscillation (QBO) dominates the variability of the tropical stratosphere on interannual time scales. The QBO has been shown to extend its influence into the chemical composition of this region through dynamical mechanisms. We have started our analysis using the realistic QBO internally generated by the Goddard Earth Observing System Version 5 (GEOS-5) general circulation model coupled to a comprehensive stratospheric and tropospheric chemical mechanism forced with observed sea surface temperatures over the past 33 years. We will show targeted comparisons with observations from NASAs Aura satellite Microwave Limb Sounder (MLS) and the Modern Era Retrospective-Analysis for Research and Applications (MERRA) reanalysis to provide insight into the simulation of the primary and secondary circulations associated with the QBO. Using frequency spectrum analysis and multiple linear regression we can illuminate the resulting circulations and deduce the strengths and weaknesses in their modeled representation. Inclusion of the QBO in our simulation improves the representation of the subtropical barriers and overall tropical variability. The QBO impact on tropical upwelling is important to quantify when calculating trends in sub-decadal scale datasets.

MERRA↗

NASA NTRS2014

Northern Winter Climate Change: Assessment of Uncertainty in CMIP5 Projections Related to Stratosphere-Troposphere Coupling

Future changes in the stratospheric circulation could have an important impact on northern winter tropospheric climate change, given that sea level pressure (SLP) responds not only to tropospheric circulation variations but also to vertically coherent variations in troposphere-stratosphere circulation. Here we assess northern winter stratospheric change and its potential to influence surface climate change in the Coupled Model Intercomparison Project-Phase 5 (CMIP5) multimodel ensemble. In the stratosphere at high latitudes, an easterly change in zonally averaged zonal wind is found for the majority of the CMIP5 models, under the Representative Concentration Pathway 8.5 scenario. Comparable results are also found in the 1% CO2 increase per year projections, indicating that the stratospheric easterly change is common feature in future climate projections. This stratospheric wind change, however, shows a significant spread among the models. By using linear regression, we quantify the impact of tropical upper troposphere warming, polar amplification, and the stratospheric wind change on SLP. We find that the intermodel spread in stratospheric wind change contributes substantially to the intermodel spread in Arctic SLP change. The role of the stratosphere in determining part of the spread in SLP change is supported by the fact that the SLP change lags the stratospheric zonally averaged wind change. Taken together, these findings provide further support for the importance of simulating the coupling between the stratosphere and the troposphere, to narrow the uncertainty in the future projection of tropospheric circulation changes.

climate change↗

DOE OSTI2014

Vibrationally resolved high-resolution NEXAFS and XPS spectra of phenanthrene and coronene

We performed a combined experimental and theoretical study of the C1s Near-Edge X-ray Absorption Fine-Structure (NEXAFS) spectroscopy and X-ray Photoelectron Spectroscopy in the gas phase of two polycyclic aromatic hydrocarbons (phenanthrene and coronene), typically formed in combustion reactions. In the NEXAFS of both molecules, a double-peak structure appears in the C1s → LUMO region, which differ by less than 1 eV in transition energies. The vibronic coupling is found to play an important role in such systems. It leads to weakening of the lower-energy peak and strengthening of the higher-energy one because the 0 − n (n > 0) vibrational progressions of the lower-energy peak appear in nearly the same region of the higher-energy peak. Vibrationally resolved theoretical spectra computed within the Frank-Condon (FC) approximation and linear coupling model agree well with the high-resolution experimental results. We find that FC-active normal modes all correspond to in-plane vibrations.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2022

Heat transfer in directly-irradiated high-temperature solid–gas flows laden with polydisperse particles

Heat transfer in directly-irradiated high-temperature solid–gas flows laden with polydisperse particles is investigated using a novel transient three-dimensional computational fluid dynamics model. The model couples particle–gas hydrodynamics of solid–gas flows laden with polydisperse particles, radiative heat transfer in non-grey absorbing, emitting and anisotropically-scattering multi-component participating media, conduction heat transfer in the gas phase, and interfacial convection heat transfer. The multiphase particle-in-cell method is used to predict high-fidelity solid–gas flow characteristics, such as the local discrete particle size distribution, with increased computational efficiency by combining the advantages of both Eulerian and Lagrangian methods. The multi-component radiative transfer model is implemented using an advanced collision-based Monte Carlo ray-tracing method. The number of the prescribed discrete particle components is found to be the key parameter affecting the computational accuracy and efficiency, which primarily depends on the size distribution of the particles. For the model particle–gas flow featuring free-falling Gamma-distributed ceramic particles exposed to concentrated solar irradiation, the particle volume fraction, radiative, fluid flow and thermal characteristics appear to converge with the increasing number of the discrete particle components. Five particle components are sufficient to obtain physically meaningful results. A further increase in the number of the particle components only slightly increases the accuracy of the numerical predictions at the expense of a rapidly increasing computational time. For five particle components, the particle vertical velocity at the receiver exit for particles with the diameter of 43.4 μm is 57% of that for the particles with the diameter of 202.8 μm. The temperatures of these two particle components increase from the initial ambient values by factors of 2 and 1.2, respectively, during the simulation time. In conclusion, the model developed allows for increased fidelity of particle–gas flow simulations with significant radiative effects.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2023

Evaluating Northern Hemisphere Growing Season Net Carbon Flux in Climate Models Using Aircraft Observations

Understanding terrestrial ecosystems and their response to anthropogenic climate change requires quantification of land-atmosphere carbon exchange. However, top-down and bottom-up estimates of large-scale land-atmosphere fluxes, including the northern extratropical growing season net flux (GSNF), show significant discrepancies. We developed a data-driven metric for the GSNF using atmospheric carbon dioxide concentration observations collected during the High-Performance Instrumented Airborne Platform for Environmental Research Pole-to-Pole Observations and Atmospheric Tomography Mission flight campaigns. This aircraft-derived metric is bias-corrected using three independent atmospheric inversion systems. We estimate the northern extratropical GSNF to be 5.7 ± 0.3 Pg C and use it to evaluate net biosphere productivity from the Coupled Model Intercomparison Project phase 5 and 6 (CMIP5 and CMIP6) models. While the model-to-model spread in the GSNF has decreased in the CMIP6 models relative to that of the CMIP5 models, there is still disagreement on the magnitude and timing of seasonal carbon uptake with most models underestimating the GSNF and overestimating the length of the growing season relative to the observations. We also use an emergent constraint approach to estimate annual northern extratropical gross primary productivity to be 56 ± 17 Pg C, heterotrophic respiration to be 25 ± 13 Pg C, and net primary productivity to be 28 ± 12 Pg C. The flux inferred from these aircraft observations provides an additional constraint on large-scale gross fluxes in prognostic Earth system models that may ultimately improve our ability to accurately predict carbon-climate feedbacks.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2022

Atmospheric teleconnection associated with the Atlantic multidecadal variability in summer: assessment of the CESM1 model

Observational analysis shows that the Atlantic multidecadal variability (AMV) is associated with climate variability in the Northern Hemisphere through a zonal atmospheric teleconnection extending from the North Atlantic Ocean and propagating eastward around the Northern Hemisphere. Here, we studied the fidelity of model simulations in reproducing the observed summer AMV and the associated impacts on the mid-latitude climate by analysing simulations using the National Centre for Atmospheric Research Community Earth System Model Version 1 (CESM1), including CESM1 North Atlantic idealized and pacemaker simulations, CESM1 large ensemble twentieth century uninitialized simulations and large ensemble initialized CESM1 decadal predictions. To further compare the fidelity of CESM1, we also analysed large ensemble simulations from three other models. Our results suggest that the uninitialized large ensemble simulations from all models can produce an AMV time evolution and its regional climate impacts similar to the observations to certain degree. By initializing the observed oceanic condition in decadal prediction simulations, the simulated AMV and its regional impacts are closer to the observed ones than those in uninitialized ensemble simulations. In addition, the pacemaker simulations that nudged the time-evolving observed North Atlantic sea surface temperature anomalies produce spatiotemporal characteristics of the AMV and AMV climate impacts closer to the observed ones than the uninitialized simulations. We conclude that although coupled models can produce AMV and its regional impacts similar to observed, proper initialization and bias correction of the sea surface temperature spatial and temporal structure can improve this capability.

Initialization↗

NASA NTRSDate not supplied

Midlatitude cyclone processes as a key to understanding climate sensitivity

Global climate models (GCMs) differ greatly in their shortwave cloud feedback. One feature that is consistent across GCMs is a positive shortwave cloud feedback in the subtropics, and a negative shortwave cloud feedback across the midlatitudes. Confidence has grown in the mechanisms that lead to, and the strength of, the subtropical shortwave cloud feedback, but the midlatitude negative shortwave cloud feedback is not well-constrained or well-understood. It is critical to reduce uncertainty in midlatitude shortwave cloud feedback. A more positive midlatitude shortwave cloud feedback in the sixth coupled model intercomparison project (CMIP6) has been found to be one of the primary causes of the increased climate sensitivity of CMIP6 models relative to CMIP5. We show that changes in midlatitude cyclones in future climates are the primary cause of the negative shortwave cloud feedback and are thus key to understanding the high climate sensitivity in the most recent GCMs. Warming-induced changes in cloud liquid water path in midlatitude cyclones can almost entirely be explained by Clausius-Clapeyron increasing moisture convergence into cyclones. One concern with simulating midlatitude cyclones is the lack of predictive skill at low resolution. A more realistic relationship between moisture flux and cyclone liquid content is found at high horizontal resolution (∆x<25km), but the cloud feedback within cyclones can be explained by increased moisture convergence across low- and high-resolution models. Observations and models agree that the extratropical shortwave cloud feedback is moderated by precipitation processes in cyclones. This rules out a large contribution from ice-to-liquid transitions, as has been hypothesized in previous studies. Understanding and constraining these precipitation processes is crucial to constraining the response of midlatitude cyclones to warming and by extension climate sensitivity.

Cyclones↗

DOE OSTI2015

Gauge-preheating and the end of axion inflation

We study the onset of the reheating epoch at the end of axion-driven inflation where the axion is coupled to an Abelian, U(1), gauge field via a Chern-Simons interaction term. We focus primarily on m{sup 2φ2} inflation and explore the possibility that preheating can occur for a range of coupling values consistent with recent observations and bounds on the overproduction of primordial black holes. We find that for a wide range of parameters preheating is efficient. In certain cases the inflaton transfers all of its energy to the gauge fields within a few oscillations. In most cases, we find that the gauge fields on sub-horizon scales end preheating in an unpolarized state due to the existence of strong rescattering between the inflaton and gauge-field modes. We also present a preliminary study of an axion monodromy model coupled to U(1) gauge fields, seeing a similarly efficient preheating behavior as well as indications that the coupling strength has an effect on the creation of oscillons.

79 ASTRONOMY AND ASTROPHYSICS↗

DOE OSTI2020

Research note: LED lighting – A global enterprise

There is considerable focus on technology manufacturing locations and the value in funding innovation when upstream products are not manufactured within a domestic economy. Light-emitting diodes (LEDs) are such an upstream product. Here, we evaluate the value added along the supply chain of luminaires, a product that utilizes LEDs, using bottom-up cost modelling. Coupling the results with analysis of shipping cost and time, this analysis examines how advances in LEDs can incentivize LED luminaire adoption leading to the potential for significant domestic manufacturing effects even if the upstream products are produced in other economies.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2017

Impacts of air pollutants from fire and non-fire emissions on the regional air quality in Southeast Asia

Severe haze events in Southeast Asia caused by particulate pollution have become more intense and frequent in recent years, degrading air quality, threatening human health, and interrupting economic and societal activities. Widespread biomass burning activities are a major source of severe haze events in Southeast Asia. On the other hand, particulate pollutants from human activities other than biomass burning also play an important role in degrading air quality in Southeast Asia. In this study, numerical simulations have been conducted using the Weather Research and Forecasting (WRF) model coupled with a chemistry component (WRF-Chem) to quantitatively examine the contributions of aerosols emitted from fire (i.e., biomass burning) versus non-fire (including fossil fuel combustion, road and industrial dust, land use, and land change, etc.) sources to the degradation of air quality and visibility over Southeast Asia. These simulations cover a time period from 2002 to 2008 and were respectively driven by emissions from: (a) fossil fuel burning only, (b) biomass burning only, and (c) both fossil fuel and biomass burning. Across ASEAN 50 cities, these model results reveal that 39 % of observed low visibility days can be explained by either fossil fuel burning or biomass burning emissions alone, a further 20 % by fossil fuel burning alone, a further 8 % by biomass burning alone, and a further 5 % by a combination of fossil fuel burning and biomass burning. The remaining 28 % of observed low visibility days remain unexplained, likely due to emissions sources that have not been accounted for. Further analysis of 24-hr PM 2.5 Air Quality Index (AQI) indicates that comparing to the simulated result of the case with stand-alone non-fire emissions, the case with coexisting fire and non-fire PM 2.5 can substantially increase the chance of AQI being in the moderate or unhealthy pollution level from 23 % to 34 %. The premature mortality among major Southeast Asian cities due to degradation of air quality by particulate pollutants is estimated to increase from ~ 4110 per year in 2002 to ~ 6540 per year in 2008. In addition, we demonstrate the importance of certain missing non-fire anthropogenic aerosol sources including anthropogenic fugitive and industrial dusts in causing urban air quality degradation. An exploratory experiment of using machine learning algorithms to forecasting the occurrence of haze events in Singapore is also demonstrated in this study. All these results suggest that besides minimizing biomass burning activities, an effective air pollution mitigation policy for Southeast Asia needs to consider controlling emissions from non-fire anthropogenic sources.

Lee, Hsiang-He (ORCID:0000000251407324)↗

NASA NTRS1993

Calculations of Supersonic and Hypersonic Flows using Compressible Wall Functions

The present paper presents a numerical procedure to calculate supersonic and hypersonic flows using the compressible law of the wall. The turbulence models under consideration include the Launder-Reece-Rodi-Gibson Reynolds-stress model and the k-epsilon model. The models coupled with the proposed wall function technique have been tested in both separated and unseparated flows. The flows include (1) an insulated flat plate flow over a range of Mach numbers, (2) a Mach 5 flat plate flow with cold wall conditions, (3) a two dimensional supersonic compression corner flow, (4) a hypersonic flow over an axisymmetric flare, and (5) a hypersonic flow over a 2-D compression corner. Results indicate that the wall function technique gives improved predictions of skin friction and heat transfer in separated flows compared with models using wall dampers. Predictions of the extent of separation are not improved over the wall damper models except with the Reynolds-stress model for the supersonic compression corner flow case.

Huang, P. G.↗

DOE OSTI2022

Improving and testing machine learning methods for benchmarking soil carbon dynamics representation of land surface models

Representation of soil organic carbon (SOC) dynamics in Earth system models (ESMs) is a key source of uncertainty in predicting carbon climate feedbacks. The magnitude of this uncertainty can be reduced by accurate representation of environmental controllers of SOC stocks in ESMs. In this study, we used data of environmental factors, field SOC observations, ESM projections and machine learning approaches to identify dominant environmental controllers of SOC stocks and derive functional relationships between environmental factors and SOC stocks. Our derived functional relationships predicted SOC stocks with similar accuracy as the machine learning approach. We used the derived relationships to benchmark the coupled model intercomparison project phase six ESM representation of SOC stocks. We found divergent environmental control representation in ESMs in comparison to field observations. Representation of SOC in ESMs can be improved by including additional environmental factors and representing their functional relationships with SOC consistent with observations.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2021

Ferroelectric Self-Polarization Controlled Magnetic Stratification and Magnetic Coupling in Ultrathin La 0.67 Sr 0.33 MnO 3 Films

Multiferroic oxide heterostructures consisting of ferromagnetic and ferroelectric components hold the promise for nonvolatile magnetic control via ferroelectric polarization, advantageous for the low-dissipation spintronics. Modern understanding of the magnetoelectric coupling in these systems involves structural, orbital, and magnetic reconstructions at interfaces. Previous works have long proposed polarization-dependent interfacial magnetic structures; however, direct evidence is still missing, which requires advanced characterization tools with near-atomic-scale spatial resolutions. Here, extensive polarized neutron reflectometry (PNR) studies have determined the magnetic depth profiles of PbZr 0.2 Ti 0.8 O 3 /La 0.67 Sr 0.33 MnO 3 (PZT/LSMO) bilayers with opposite self-polarizations. When the LSMO is 2–3 nm thick, the bilayers show two magnetic transitions on cooling. However, temperature-dependent magnetization is different below the lower-temperature transition for opposite polarizations. PNR finds that the LSMO splits into two magnetic sublayers, but the inter-sublayer magnetic couplings are of opposite signs for the two polarizations. Near-edge X-ray absorption spectroscopy further shows contrasts in both the Mn valences and the Mn–O bond anisotropy between the two polarizations. Finally, this work completes the puzzle for the magnetoelectric coupling model at the PZT/LSMO interface, showing a synergic interplay among multiple degrees of freedom toward emergent functionalities at complex oxide interfaces.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2015

Representative-Sandwich Model for Mechanical-Crush and Short-Circuit Simulation of Lithium-ion Batteries

Lithium-ion batteries are currently the state-of-the-art power sources for a variety of applications, from consumer electronic devices to electric-drive vehicles (EDVs). Being an energized component, failure of the battery is an essential concern, which can result in rupture, smoke, fire, or venting. The failure of Lithium-ion batteries can be due to a number of external abusive conditions (impact/crush, overcharge, thermal ramp, etc.) or internal conditions (internal short circuits, excessive heating due to resistance build-up, etc.), of which the mechanical-abuse-induced short circuit is a very practical problem. In order to better understand the behavior of Lithium-ion batteries under mechanical abuse, a coupled modeling methodology encompassing the mechanical, thermal and electrical response has been developed for predicting short circuit under external crush.

33 ADVANCED PROPULSION SYSTEMS↗

DOE OSTI2013

Nonlinear excitation of low-n harmonics in reduced magnetohydrodynamic simulations of edge-localized modes

Nonlinear simulations of the early edge-localized mode (ELM) phase based on a typical type-I ELMy ASDEX Upgrade discharge have been carried out using the reduced MHD code JOREK. The analysis is focused on the evolution of the toroidal Fourier spectrum. It is found that during the nonlinear evolution, linearly subdominant low-n Fourier components, in particular the n = 1, grow to energies comparable with linearly dominant harmonics. A simple model is developed, based on the idea that energy is transferred among the toroidal harmonics via second order nonlinear interaction. The simple model reproduces and explains very well the early nonlinear evolution of the toroidal spectrum in the JOREK simulations. Furthermore, it is shown for the n = 1 harmonic, that its spatial structure changes significantly during the transition from linear to nonlinearly driven growth. The rigidly growing structure of the linearly barely unstable n = 1 reaches far into the plasma core. In contrast, the nonlinearly driven n= 1 has a rigidly growing structure localized at the plasma edge, where the dominant toroidal harmonics driving the n = 1 are maximal and in phase. The presented quadratic coupling model might explain the recent experimental observation of strong low-n components in magnetic measurements [Wenninger et al., “Non-linear magnetic perturbations during edge localized modes in TCV dominated by low n mode components,” Nucl. Fusion (submitted)].

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2014

Future projection of mean and variability of the Asian Summer Monsoon and Indian Ocean Climate systems

The overall goal of this project is to assess the ability of the CMIP3/5 models to simulate the Indian-Ocean monsoon systems. The PI along with post-docs investigated research issues ranging from synoptic systems to long-term trends over the Asian monsoon region. The PI applied diagnostic tools such as moist static energy (MSE) to isolate: the moist and radiative processes responsible for extended monsoon breaks over South Asia, precursors in the ENSO-monsoon association, reasons for the drying tendency over South Asia and the possible effect on tropical Indian Ocean climate anomalies influencing certain aspects of ENSO characteristics. By diagnosing various observations and coupled model simulations, we developed working hypothesis and tested them by carrying out sensitivity experiments with both linear and nonlinear models. Possible physical and dynamical reasons for model sensitivities were deduced. On the teleconnection front, the ability of CMIP5 models in representing the monsoon-desert mechanism was examined recently. Further more, we have applied a suite of diagnostics and have performed an in depth analysis on CMIP5 integrations to isolate the possible reasons for the ENSO-monsoon linkage or lack thereof. The PI has collaborated with Dr. K.R. Sperber of PCMDI and other CLIVAR Asian-Australian monsoon panel members in understanding the ability of CMIP3/5 models in capturing monsoon and its spectrum of variability. The objective and process-based diagnostics aided in selecting models that best represent the present-day monsoon and its variability that are then employed for future projections. Two major highlights were an invitation to write a review on present understanding monsoons in a changing climate in Nature Climate Change, and identification of an east-west shift in observed monsoon rainfall (more rainfall over tropical western Pacific and drying tendency over South Asia) in the last six decades and attributing that shift to SST rise over the tropical western Pacific. On the training of post-doctoral scientists: the PI spent considerable amount of time and efforts in introducing the post-docs into climate modeling and designing the numerical experiments. With training provided and knowledge gained, post-docs worked in the project obtained long term positions elsewhere. The PI also enjoyed the experience in managing the works and educating work ethics to the younger generation. Based on the research achievements and publications, the PI gave invited talks in major international monsoon conferences/workshops, and gave lectures in various research organizations in the last six years. Finally, during the project period, the PI attended all the DOE organized PIs meeting and presented the major results. Some of the major implications of the project include: (i) Sustained observational efforts are necessary to monitor the three-dimensional moisture distribution over the Asian monsoon region that would aid in better understanding, modeling and predicting severe monsoons well in advance and (ii) process-based diagnostics lead pathways for model improvements.

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS2006

A Unique Perspective from Space on our Planet: Science, Technologies and Applications

The study of Planet earth is a very complex problem. It has many non-linear and chaotic systems operating in parallel and have interdependencies. In reality, these systems/phenomena s are not well understood or mathematically modeled because of our lack of knowledge of such intricate processes. However, in order to further the subject of Earth as an integrated system, space provides excellent vantage points to look at these processes in multidimensional framework. For example, we can make strives to understand the global water cycle, carbon cycle, atmospheric chemistry, biomass changes, oceans and solid Earth variations by making multitude of global measurements such as soil moisture, precipitation, tropospheric and stratospheric gases, aerosols, tropospheric winds, ocean salinity, ocean color, vegetation cover, crustal dynamics and many more. Such suites of measurements derive the coupled models so we may predict the changes due to natural and anthropogenic forcing. NASA along with other international space agencies have made tremendous investments in recent years in developing and flying remote sensing space borne sensors to enable these measurements. These science measurements and products are further used to address pressing issues such as coastal zone erosion, air quality, severe weather, water availability and quality, public health, fires, earthquakes, land slides and others for societal benefits. This presentation provides a comprehensive overview of NASA s science investigations, related technologies and satellites/sensors and applications.

Habib, Shaid↗

NASA NTRS2017

Comparisons of Mixed-Phase Icing Cloud Simulations with Experiments Conducted at the NASA Propulsion Systems Laboratory

This paper builds on previous work that compares numerical simulations of mixed-phase icing clouds with experimental data. The model couples the thermal interaction between ice particles and water droplets of the icing cloud with the flowing air of an icing wind tunnel for simulation of NASA Glenn Research Centers (GRC) Propulsion Systems Laboratory (PSL). Measurements were taken during the Fundamentals of Ice Crystal Icing Physics Tests at the PSL tunnel in March 2016. The tests simulated ice-crystal and mixed-phase icing that relate to ice accretions within turbofan engines. Experimentally measured air temperature, humidity, total water content, liquid and ice water content, as well as cloud particle size, are compared with model predictions. The model showed good trend agreement with experimentally measured values, but often over-predicted aero-thermodynamic changes. This discrepancy is likely attributed to radial variations that this one-dimensional model does not address. One of the key findings of this work is that greater aero-thermodynamic changes occur when humidity conditions are low. In addition a range of mixed-phase clouds can be achieved by varying only the tunnel humidity conditions, but the range of humidities to generate a mixed-phase cloud becomes smaller when clouds are composed of smaller particles. In general, the model predicted melt fraction well, in particular with clouds composed of larger particle sizes.

Thermal model↗