arXiv subjects

Elspeth K. H. Lee

Publications and source records attributed to Elspeth K. H. Lee.

At least 55 records · Page 3Linked to original sources

arXiv2023

Photochemically-produced SO$_2$ in the atmosphere of WASP-39b

Photochemistry is a fundamental process of planetary atmospheres that regulates the atmospheric composition and stability. However, no unambiguous photochemical products have been detected in exoplanet atmospheres to date. Recent observations from the JWST Transiting Exoplanet Early Release Science Program found a spectral absorption feature at 4.05 $μ$m arising from SO$_2$ in the atmosphere of WASP-39b. WASP-39b is a 1.27-Jupiter-radii, Saturn-mass (0.28 M$_J$) gas giant exoplanet orbiting a Sun-like star with an equilibrium temperature of $\sim$1100 K. The most plausible way of generating SO$_2$ in such an atmosphere is through photochemical processes. Here we show that the SO$_2$ distribution computed by a suite of photochemical models robustly explains the 4.05 $μ$m spectral feature identified by JWST transmission observations with NIRSpec PRISM (2.7$σ$) and G395H (4.5$σ$). SO$_2$ is produced by successive oxidation of sulphur radicals freed when hydrogen sulphide (H$_2$S) is destroyed. The sensitivity of the SO$_2$ feature to the enrichment of the atmosphere by heavy elements (metallicity) suggests that it can be used as a tracer of atmospheric properties, with WASP-39b exhibiting an inferred metallicity of $\sim$10$\times$ solar. We further point out that SO$_2$ also shows observable features at ultraviolet and thermal infrared wavelengths not available from the existing observations.

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arXiv2023

A Mini-Chemical Scheme with Net Reactions for 3D GCMs II. 3D thermochemical modelling of WASP-39b and HD 189733b

The chemical inventory of hot Jupiter (HJ) exoplanets atmospheres continue to be observed by various ground and space based instruments in increasing detail and precision. It is expected that some HJs will exhibit strong non-equilibrium chemistry characteristics in their atmospheres, which might be inferred from spectral observations. We aim to model the three dimensional thermochemical non-equilibrium chemistry in the atmospheres of the HJs WASP-39b and HD 189733b. We couple a lightweight, reduced chemical network `mini-chem' that utilises net reaction rate tables to the Exo-FMS General Circulation Model (GCM). We perform GCM models of the exoplanets WASP-39b and HD 189733b as case studies of the coupled mini-chem scheme. The GCM results are then post-processed using the 3D radiative-transfer model gCMCRT to produce transmission and emission spectra to assess the impact of non-equilibrium chemistry on their observable properties. Both simulations show significant departures from chemical equilibrium (CE) due to the dynamical motions of the atmosphere. The spacial distribution of species generally follows closely the dynamical features of the atmosphere rather than the temperature field. Each molecular species exhibits a different quench level in the simulations, also dependent on the latitude of the planet. Major differences are seen in the transmission and emission spectral features between the CE and kinetic models. Our simulations indicate that considering the 3D kinetic chemical structures of HJ atmospheres has an important impact on physical interpretation of observational data. Drawing bulk atmospheric parameters from fitting feature strengths may lead to inaccurate interpretation of chemical conditions in the atmosphere of HJs. Our open source mini-chem module is simple to couple with contemporary HJ GCM models without substantially increasing required computational resources.

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arXiv2023

A broadband thermal emission spectrum of the ultra-hot Jupiter WASP-18b

Close-in giant exoplanets with temperatures greater than 2,000 K (''ultra-hot Jupiters'') have been the subject of extensive efforts to determine their atmospheric properties using thermal emission measurements from the Hubble and Spitzer Space Telescopes. However, previous studies have yielded inconsistent results because the small sizes of the spectral features and the limited information content of the data resulted in high sensitivity to the varying assumptions made in the treatment of instrument systematics and the atmospheric retrieval analysis. Here we present a dayside thermal emission spectrum of the ultra-hot Jupiter WASP-18b obtained with the NIRISS instrument on JWST. The data span 0.85 to 2.85 $μ$m in wavelength at an average resolving power of 400 and exhibit minimal systematics. The spectrum shows three water emission features (at $>$6$σ$ confidence) and evidence for optical opacity, possibly due to H$^-$, TiO, and VO (combined significance of 3.8$σ$). Models that fit the data require a thermal inversion, molecular dissociation as predicted by chemical equilibrium, a solar heavy element abundance (''metallicity'', M/H = 1.03$_{-0.51}^{+1.11}$ $\times$ solar), and a carbon-to-oxygen (C/O) ratio less than unity. The data also yield a dayside brightness temperature map, which shows a peak in temperature near the sub-stellar point that decreases steeply and symmetrically with longitude toward the terminators.

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arXiv2022

Early Release Science of the Exoplanet WASP-39b with JWST NIRSpec G395H

Measuring the abundances of carbon and oxygen in exoplanet atmospheres is considered a crucial avenue for unlocking the formation and evolution of exoplanetary systems. Access to an exoplanet's chemical inventory requires high-precision observations, often inferred from individual molecular detections with low-resolution space-based and high-resolution ground-based facilities. Here we report the medium-resolution (R$\sim$600) transmission spectrum of an exoplanet atmosphere between 3-5 $μ$m covering multiple absorption features for the Saturn-mass exoplanet WASP-39b, obtained with JWST NIRSpec G395H. Our observations achieve 1.46x photon precision, providing an average transit depth uncertainty of 221 ppm per spectroscopic bin, and present minimal impacts from systematic effects. We detect significant absorption from CO$_2$ (28.5$σ$) and H$_2$O (21.5$σ$), and identify SO$_2$ as the source of absorption at 4.1 $μ$m (4.8$σ$). Best-fit atmospheric models range between 3 and 10x solar metallicity, with sub-solar to solar C/O ratios. These results, including the detection of SO$_2$, underscore the importance of characterising the chemistry in exoplanet atmospheres, and showcase NIRSpec G395H as an excellent mode for time series observations over this critical wavelength range.

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arXiv2022

CAMEMBERT: A Mini-Neptunes GCM Intercomparison, Protocol Version 1.0. A CUISINES Model Intercomparison Project

With an increased focus on the observing and modelling of mini-Neptunes, there comes a need to better understand the tools we use to model their atmospheres. In this paper, we present the protocol for the CAMEMBERT (Comparing Atmospheric Models of Extrasolar Mini-neptunes Building and Envisioning Retrievals and Transits) project, an intercomparison of general circulation models (GCMs) used by the exoplanetary science community to simulate the atmospheres of mini-Neptunes. We focus on two targets well studied both observationally and theoretically with planned JWST Cycle 1 observations: the warm GJ~1214b and the cooler K2-18b. For each target, we consider a temperature-forced case, a clear sky dual-grey radiative transfer case, and a clear sky multi band radiative transfer case, covering a range of complexities and configurations where we know differences exist between GCMs in the literature. This paper presents all the details necessary to participate in the intercomparison, with the intention of presenting the results in future papers. Currently, there are eight GCMs participating (ExoCAM, Exo-FMS, FMS PCM, Generic PCM, MITgcm, RM-GCM, THOR, and the UM), and membership in the project remains open. Those interested in participating are invited to contact the authors.

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arXiv2022

The Mantis Network II: Examining the 3D high-resolution observable properties of the UHJs WASP-121b and WASP-189b through GCM modelling

The atmospheres of ultra hot Jupiters (UHJs) are prime targets for the detection of molecules and atoms at both low and high spectral resolution. We study the atmospheres of the UHJs WASP-121b and WASP-189b by performing 3D general circulation models (GCMs) of these planets using high temperature correlated-k opacity schemes with ultra-violet (UV) absorbing species included. The GCM results are then post-processed at low and high spectral resolutions and compared to available data. The high resolution results are cross-correlated with molecular and atomic templates to produce mock molecular detections. Our GCM models produce similar temperature-pressure (T-p) structure trends to previous 1D radiative-convective equilibrium models of UHJs. Furthermore, the inclusion of UV opacities greatly shapes the thermal and dynamical properties of the high-altitude, low-pressure regions of the UHJ atmospheres, with sharp T-p inversions due to the absorption of UV light. This suggests that optical wavelength, high-resolution observations probe a dynamically distinct upper atmospheric region, rather than the deeper jet forming layers.

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arXiv2022

Identification of carbon dioxide in an exoplanet atmosphere

Carbon dioxide (CO2) is a key chemical species that is found in a wide range of planetary atmospheres. In the context of exoplanets, CO2 is an indicator of the metal enrichment (i.e., elements heavier than helium, also called "metallicity"), and thus formation processes of the primary atmospheres of hot gas giants. It is also one of the most promising species to detect in the secondary atmospheres of terrestrial exoplanets. Previous photometric measurements of transiting planets with the Spitzer Space Telescope have given hints of the presence of CO2 but have not yielded definitive detections due to the lack of unambiguous spectroscopic identification. Here we present the detection of CO2 in the atmosphere of the gas giant exoplanet WASP-39b from transmission spectroscopy observations obtained with JWST as part of the Early Release Science Program (ERS). The data used in this study span 3.0 to 5.5 μm in wavelength and show a prominent CO2 absorption feature at 4.3 μm (26σ significance). The overall spectrum is well matched by one-dimensional, 10x solar metallicity models that assume radiative-convective-thermochemical equilibrium and have moderate cloud opacity. These models predict that the atmosphere should have water, carbon monoxide, and hydrogen sulfide in addition to CO2, but little methane. Furthermore, we also tentatively detect a small absorption feature near 4.0 μm that is not reproduced by these models.

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arXiv2022

Patchy nightside clouds on ultra-hot Jupiters: General Circulation Model simulations with radiatively active cloud tracers

The atmospheres of ultra-hot Jupiters have been characterized in detail through recent phase curve and low- and high-resolution emission and transmission spectroscopic observations. Previous numerical studies have analyzed the effect of the localized recombination of hydrogen on the atmospheric dynamics and heat transport of ultra-hot Jupiters, finding that hydrogen dissociation and recombination lead to a reduction in the day-to-night contrasts of ultra-hot Jupiters relative to previous expectations. In this work, we add to previous efforts by also considering the localized condensation of clouds in the atmospheres of ultra-hot Jupiters, their resulting transport by the atmospheric circulation, and the radiative feedback of clouds on the atmospheric dynamics. To do so, we include radiatively active cloud tracers into the existing MITgcm framework for simulating the atmospheric dynamics of ultra-hot Jupiters. We take cloud condensate properties appropriate for the high-temperature condensate corundum from CARMA cloud microphysics models. We conduct a suite of GCM simulations with varying cloud microphysical and radiative properties, and we find that partial cloud coverage is a ubiquitous outcome of our simulations. This patchy cloud distribution is inherently set by atmospheric dynamics in addition to equilibrium cloud condensation, and causes a cloud greenhouse effect that warms the atmosphere below the cloud deck. Nightside clouds are further sequestered at depth due to a dynamically induced high-altitude thermal inversion. We post-process our GCMs with the Monte Carlo radiative transfer code gCMCRT and find that the patchy clouds on ultra-hot Jupiters do not significantly impact transmission spectra but can affect their phase-dependent emission spectra.

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arXiv2022

A Mini-Chemical Scheme with Net Reactions for 3D GCMs I.: Thermochemical Kinetics

Growing evidence has indicated that the global composition distribution plays an indisputable role in interpreting observational data. 3D general circulation models (GCMs) with a reliable treatment of chemistry and clouds are particularly crucial in preparing for the upcoming observations. In the effort of achieving 3D chemistry-climate modeling, the challenge mainly lies in the expensive computing power required for treating a large number of chemical species and reactions. Motivated by the need for a robust and computationally efficient chemical scheme, we devise a mini-chemical network with a minimal number of species and reactions for H$_2$-dominated atmospheres. We apply a novel technique to simplify the chemical network from a full kinetics model -- VULCAN by replacing a large number of intermediate reactions with net reactions. The number of chemical species is cut down from 67 to 12, with the major species of thermal and observational importance retained, including H$_2$O, CH$_4$, CO, CO$_2$, C$_2$H$_2$, NH$_3$, and HCN. The size of the total reactions is greatly reduced from $\sim$ 800 to 20. The mini-chemical scheme is validated by verifying the temporal evolution and benchmarking the predicted compositions in four exoplanet atmospheres (GJ 1214b, GJ 436b, HD 189733b, HD 209458b) against the full kinetics of VULCAN. It reproduces the chemical timescales and composition distributions of the full kinetics well within an order of magnitude for the major species in the pressure range of 1 bar -- 0.1 mbar across various metallicities and carbon-to-oxygen (C/O) ratios. The small scale of the mini-chemical scheme permits simple use and fast computation, which is optimal for implementation in a 3D GCM or a retrieval framework. We focus on the thermochemical kinetics of net reactions in this paper and address photochemistry in a follow-up paper.

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arXiv2022

Sunbathing under white light -- 3D modelling of brown dwarf - white dwarf atmospheres with strong UV irradiation

The atmospheres of brown dwarfs orbiting in close proximity to their parent white dwarf represent some of the most extreme irradiated environments known. Understanding their complex dynamical mechanisms pushes the limits of theoretical and modelling efforts, making them valuable objets to study to test contemporary understanding of irradiated atmospheres. We use the Exo-FMS GCM to simulate the brown dwarfs WD0137-349B, SDSS J141126.20+200911.1B and EPIC212235321B, first coupled to a multi-banded grey radiative-transfer scheme then a spectral correlated-k scheme with high temperature opacity tables. We then post-process the GCM results using gCMCRT to compare to available observational data. Our GCM models predict strongly temperature inverted atmospheres, spanning many decades in pressure due to impact of UV band heating. Post-processing of our models suggest that the day-night contrast is too small in the GCM results. We therefore suggest that the formation of cloud particles as well as atmospheric drag effects such as magnetic drag are important considerations in setting the day-night temperature contrast for these objects.

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arXiv2022

3D radiative-transfer for exoplanet atmospheres. gCMCRT: a GPU accelerated MCRT code

Radiative-transfer (RT) is a key component for investigating atmospheres of planetary bodies. With the 3D nature of exoplanet atmospheres being important in giving rise to their observable properties, accurate and fast 3D methods are required to be developed to meet future multi-dimensional and temporal data sets. We develop an open source GPU RT code, gCMCRT, a Monte Carlo RT forward model for general use in planetary atmosphere RT problems. We aim to automate the post-processing pipeline, starting from direct global circulation model (GCM) output to synthetic spectra. We develop albedo, emission and transmission spectra modes for 3D and 1D input structures. We include capability to use correlated-k and high-resolution opacity tables, the latter of which can be Doppler shifted inside the model. We post-process results from several GCM groups including ExoRad, SPARC/MITgcm THOR, UK Met Office UM, Exo-FMS and the Rauscher model. Users can therefore take advantage of desktop and HPC GPU computing solutions. gCMCRT is well suited for post-processing large GCM model grids produced by members of the community and for high-resolution 3D investigations.

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arXiv2022

Cloud-convection feedback in brown dwarfs atmosphere

Numerous observational evidence has suggested the presence of active meteorology in the atmospheres of brown dwarfs. A near-infrared brightness variability has been observed. Clouds have a major role in shaping the thermal structure and spectral properties of these atmospheres. The mechanism of such variability is still unclear and both 1D and global circulation model cannot fully study this topics due to resolution. In this study, a convective resolving model is coupled to grey-band radiative transfer in order to study the coupling between the convective atmosphere and the variability of clouds over a large temperature range with a domain of several hundreds of kilometers. Six types of clouds are considered, with microphysics including settling. The clouds are radiatively active using Rosseland mean coefficient. Radiative cloud feedback can drive spontaneous atmospheric variability in both temperature and cloud structure, as modeled for the first time in three dimensions. Silicate clouds have the most effect of the thermal structure with the generation of a secondary convective layer in some cases, depending on the assumed particle size. Iron and Aluminum clouds also have a substantial impact on the atmosphere. Thermal spectra were computed, and we find the strongest effect of clouds is the smoothing of spectral features at optical wavelengths. Compared to observed L and T dwarfs on color-magnitude diagram, the simulated atmospheres are redder for most of the cases. The simulations with the presence of cloud holes are closer to the observations.

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arXiv2021

All along the line of sight: a closer look at opening angles and absorption regions in the atmospheres of transiting exoplanets

Transmission spectra contain a wealth of information about the atmospheres of transiting exoplanets. However, large thermal and chemical gradients along the line of sight can lead to biased inferences in atmospheric retrievals. In order to determine how far from the limb plane the atmosphere still impacts the transmission spectrum, we derive a new formula to estimate the opening angle of a planet. This is the angle subtended by the atmospheric region that contributes to the observation along the line of sight, as seen from the planet centre. We benchmark our formula with a 3D Monte-Carlo radiative transfer code and we define an opening angle suitable for the interpretation of JWST observations, assuming a 10-ppm noise floor. We find that the opening angle is only a few degrees for planets cooler than ca. 500 Kelvins, while it can be as large as 25 degrees for (ultra-)hot Jupiters and 50 degrees for hot Neptunes. Compared to previous works, our more robust approach leads to smaller estimates for the opening angle across a wide range scale heights and planetary radii. Finally, we show that ultra-hot Jupiters have an opening angle that is smaller than the angle over which the planet rotates during the transit. This allows for time-resolved transmission spectroscopy observations that probe independent parts of the planetary limb during the first and second half of the transit.

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arXiv2021

How Does Thermal Scattering Shape the Infrared Spectra of Cloudy Exoplanets? A Theoretical Framework and Consequences for Atmospheric Retrievals in the JWST era

Observational studies of exoplanets are suggestive of a ubiquitous presence of clouds. The current modelling techniques used in emission to account for the clouds tend to require prior knowledge of the cloud condensing species and often do not consider the scattering effects of the cloud. We explore the effects that thermal scattering has on the emission spectra by modelling a suite of hot Jupiter atmospheres with varying cloud single-scattering albedos (SSAs) and temperature profiles. We examine cases ranging from simple isothermal conditions to more complex structures and physically driven cloud modelling. We show that scattering from nightside clouds would lead to brightness temperatures that are cooler than the real atmospheric temperature if scattering is unaccounted for. We show that scattering can produce spectral signatures in the emission spectrum even for isothermal atmospheres. We identify the retrieval degeneracies and biases that arise in the context of simulated JWST spectra when the scattering from the clouds dominates the spectral shape. Finally, we propose a novel method of fitting the SSA spectrum of the cloud in emission retrievals, using a technique that does not require any prior knowledge of the cloud chemical or physical properties.

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arXiv2021

Simulating gas giant exoplanet atmospheres with Exo-FMS: Comparing semi-grey, picket fence and correlated-k radiative-transfer schemes

Radiative-transfer (RT) is a fundamental part of modelling exoplanet atmospheres with general circulation models (GCMs). An accurate RT scheme is required for estimates of the atmospheric energy transport and for gaining physical insight from model spectra. We implement three RT schemes for Exo-FMS: semi-grey, non-grey `picket fence', and real gas with correlated-k. We benchmark the Exo-FMS GCM using these RT schemes to hot Jupiter simulation results from the literature. We perform a HD 209458b-like simulation with the three schemes and compare their results. These simulations are then post-processed to compare their observable differences. The semi-grey scheme results show qualitative agreement with previous studies in line with variations seen between GCM models. The real gas model reproduces well the temperature and dynamical structures from other studies. After post-processing our non-grey picket fence scheme compares very favourably with the real gas model, producing similar transmission spectra, emission spectra and phase curve behaviours. Exo-FMS is able to reliably reproduce the essential features of contemporary GCM models in the hot gas giant regime. Our results suggest the picket fence approach offers a simple way to improve upon RT realism beyond semi-grey schemes.

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arXiv2021

Decomposing the Iron Cross-Correlation Signal of the Ultra-Hot Jupiter WASP-76b in Transmission using 3D Monte-Carlo Radiative Transfer

Ultra-hot Jupiters are tidally locked gas giants with dayside temperatures high enough to dissociate hydrogen and other molecules. Their atmospheres are vastly non-uniform in terms of chemistry, temperature and dynamics, and this makes their high-resolution transmission spectra and cross-correlation signal difficult to interpret. In this work, we use the SPARC/MITgcm global circulation model to simulate the atmosphere of the ultra-hot Jupiter WASP-76b under different conditions, such as atmospheric drag and the absence of TiO and VO. We then employ a 3D Monte-Carlo radiative transfer code, HIRES-MCRT, to self-consistently model high-resolution transmission spectra with iron (Fe I) lines at different phases during the transit. To untangle the structure of the resulting cross-correlation map, we decompose the limb of the planet into four sectors, and we analyse each of their contributions separately. Our experiments demonstrate that the cross-correlation signal of an ultra-hot Jupiter is primarily driven by its temperature structure, rotation and dynamics, while being less sensitive to the precise distribution of iron across the atmosphere. We also show that the previously published iron signal of WASP-76b can be reproduced by a model featuring iron condensation on the leading limb. Alternatively, the signal may be explained by a substantial temperature asymmetry between the trailing and leading limb, where iron condensation is not strictly required to match the data. Finally, we compute the $K_{p}-V_{sys}$ maps of the simulated WASP-76b atmospheres, and we show that rotation and dynamics can lead to multiple peaks that are displaced from zero in the planetary rest frame.

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arXiv2020

Simplified 3D GCM modelling of the irradiated brown dwarf WD0137-349B

Context: White dwarf - Brown dwarf short period binaries (P$_{\rm orb}$ $\lesssim$ 2 hours) are some of the most extreme irradiated atmospheric environments known. These systems offer an opportunity to explore theoretical and modelling efforts of irradiated atmospheres different to typical hot Jupiter systems. Aims: We aim to investigate the three dimensional atmospheric structural and dynamical properties of the Brown dwarf WD0137-349B. Methods: We use the three dimensional GCM model Exo-FMS, with a dual-band grey radiative-transfer scheme to model the atmosphere of WD0137-349B. The results of the GCM model are post-processed using the three dimensional Monte Carlo radiative-transfer model \textsc{cmcrt}. Results: Our results suggest inefficient day-night energy transport and a large day-night temperature contrast for WD0137-349B. Multiple flow patterns are present, shifting energy asymmetrically eastward or westward depending on their zonal direction and latitude. Regions of overturning are produced on the western terminator. We are able to reproduce the start of the system near-IR emission excess at $\gtrsim$ 1.95 $μ$m as observed by the GNIRS instrument. Our model over predicts the IR phase curve fluxes by factors of $\approx$1-3, but generally fits the shape of the phase curves well. Chemical kinetic modelling using \textsc{vulcan} suggests a highly ionised region at high altitudes can form on the dayside of the Brown dwarf. Conclusions: We present a first attempt at simulating the atmosphere of a short period White dwarf - Brown dwarf binary in a 3D setting. Further studies into the radiative and photochemical heating from the UV irradiation is required to more accurately capture the energy balance inside the Brown dwarf atmosphere. Cloud formation may also play an important role in shaping the emission spectra of the Brown dwarf.

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arXiv2020

Aerosol Composition of Hot Giant Exoplanets Dominated by Silicates and Hydrocarbon Hazes

Aerosols are common in the atmospheres of exoplanets across a wide swath of temperatures, masses, and ages. These aerosols strongly impact observations of transmitted, reflected, and emitted light from exoplanets, obfuscating our understanding of exoplanet thermal structure and composition. Knowing the dominant aerosol composition would facilitate interpretations of exoplanet observations and theoretical understanding of their atmospheres. A variety of compositions have been proposed, including metal oxides and sulphides, iron, chromium, sulphur, and hydrocarbons. However, the relative contributions of these species to exoplanet aerosol opacity is unknown. Here we show that the aerosol composition of giant exoplanets observed in transmission is dominated by silicates and hydrocarbons. By constraining an aerosol microphysics model with trends in giant exoplanet transmission spectra, we find that silicates dominate aerosol opacity above planetary equilibrium temperatures of 950 K due to low nucleation energy barriers and high elemental abundances, while hydrocarbon aerosols dominate below 950 K due to an increase in methane abundance. Our results are robust to variations in planet gravity and atmospheric metallicity within the range of most giant transiting exoplanets. We predict that spectral signatures of condensed silicates in the mid-infrared are most prominent for hot (>1600 K), low-gravity (<10 m s$^{-2}$) objects.

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