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Direct air capture (DAC) of carbon dioxide is a critical technology for mitigating climate change, but current materials face limitations in efficiency and scalability. We discover novel DAC materials using a combined machine learning (ML) and high-throughput atomistic modeling approach. Our ML model accurately predicts high-quality, density functional theory-computed CO$_{2}$ binding enthalpies for a wide range of nitrogen-bearing moieties. Leveraging this model, we rapidly screen over 1.6 million binding sites from a comprehensive database of theoretically feasible molecules to identify materials with superior CO$_{2}$ binding properties. Additionally, we assess the synthesizability and experimental feasibility of these structures using established ML metrics, discovering nearly 2,500 novel materials suitable for integration into DAC devices. Altogether, our high-fidelity database and ML framework represent a significant advancement in the rational development of scalable, cost-effective carbon dioxide capture technologies, offering a promising pathway to meet key targets in the global initiative to combat climate change., Comment: 18 pages, 6 figures

We present a velocity-resolved reverberation mapping analysis of the hypervariable quasar RM160 (SDSS J141041.25+531849.0) at z = 0.359 with 153 spectroscopic epochs of data representing a ten-year baseline (2013-2023). We split the baseline into two regimes based on the 3x flux increase in the light curve: a 'low state' phase during the years 2013-2019 and a 'high state' phase during the years 2022-2023. The velocity-resolved lag profiles (VRLP) indicate that gas with different kinematics dominates the line emission in different states. The H\b{eta} VRLP begins with a signature of inflow onto the BLR in the 'low state', while in the 'high state' it is flatter with less signature of inflow. The H{\alpha} VRLP begins consistent with a virialized BLR in the 'low state', while in the 'high state' shows a signature of inflow. The differences in the kinematics between the Balmer lines and between the 'low state' and the 'high state' suggests complex BLR dynamics. We find that the BLR radius and velocity (both FWHM and {\sigma}) do not obey a constant virial product throughout the monitoring period. We find that BLR lags and continuum luminosity are correlated, consistent with rapid response of the BLR gas to the illuminating continuum. The BLR kinematic profile changes in unpredictable ways that are not related to continuum changes and reverberation lag. Our observations indicate that non-virial kinematics can significantly contribute to observed line profiles, suggesting caution for black-hole mass estimation in luminous and highly varying quasars like RM160., Comment: 23 pages, 17 figures

We present dynamical modeling of the broad-line region (BLR) for the highly variable AGN SDSS J141041.25+531849.0 ($z = 0.359$) using photometric and spectroscopic monitoring data from the Sloan Digital Sky Survey Reverberation Mapping project and the SDSS-V Black Hole Mapper program, spanning from early 2013 to early 2023. We model the geometry and kinematics of the BLR in the H$\beta$, H$\alpha$, and MgII, emission lines for three different time periods to measure the potential change of structure within the BLR across time and line species. We consistently find a moderately edge-on $(i_{\rm full-state} = 53.29^{\circ} \,{}^{+7.29}_{-6.55})$ thick-disk $(\theta_{\rm opn, \; full-state} = 54.86^{\circ} \,{}^{+5.83}_{-4.74})$ geometry for all BLRs, with a joint estimate for the mass of the supermassive black hole (SMBH) for each of three time periods, yielding $\log_{10}(M_{\rm BH} / M_{\odot}) = 7.66^{+0.12}_{-0.13}$ when using the full dataset. The inferred individual virial factor $f$ $\sim 1$ is significantly smaller than the average factor for a local sample of dynamically modeled AGNs. There is strong evidence for non-virial motion, with over $80\%$ of clouds on inflowing/outflowing orbits. We analyze the change in model parameters across emission lines, finding the radii of BLRs for the emission lines are consistent with the following relative sizes $R_{\rm H\beta} \lesssim R_{\rm MgII } \lesssim R_{\rm H\alpha}$. Comparing results across time, we find $R_{\rm low-state} \lesssim R_{\rm high-state}$, with the change in BLR size for H$\beta$, being more significant than for the other two lines. The data also reveal complex, time-evolving, and potentially transient dynamics of the BLR gas over decade-long timescales, encouraging for future dynamical modeling of fine-scale BLR kinematics., Comment: 32 pages, 16 figures, 4 tables. Submitted to ApJ

"Changing-look" active galactic nuclei (CL-AGNs) challenge our basic ideas about the physics of accretion flows and circumnuclear gas around supermassive black holes. Using first-year Sloan Digital Sky Survey V (SDSS-V) repeated spectroscopy of nearly 29,000 previously known AGNs, combined with dedicated follow-up spectroscopy, and publicly available optical light curves, we have identified 116 CL-AGNs where (at least) one broad emission line has essentially (dis-)appeared, as well as 88 other extremely variable systems. Our CL-AGN sample, with 107 newly identified cases, is the largest reported to date, and includes $\sim0.4\%$ of the AGNs reobserved in first-year SDSS-V operations. Among our CL-AGNs, 67% exhibit dimming while 33% exhibit brightening. Our sample probes extreme AGN spectral variability on months to decades timescales, including some cases of recurring transitions on surprisingly short timescales ($\lesssim 2$ months in the rest frame). We find that CL events are preferentially found in lower-Eddington-ratio ($f_{Edd}$) systems: Our CL-AGNs have a $f_{Edd}$ distribution that significantly differs from that of a carefully constructed, redshift- and luminosity-matched control sample (Anderson-Darling test yielding $p_{\rm AD}\approx 6\times10^{-5}$; median $f_{Edd}\approx0.025$ vs. $0.043$). This preference for low $f_{Edd}$ strengthens previous findings of higher CL-AGN incidence at lower $f_{Edd}$, found in smaller samples. Finally, we show that the broad MgII emission line in our CL-AGN sample tends to vary significantly less than the broad H$\beta$ emission line. Our large CL-AGN sample demonstrates the advantages and challenges in using multi-epoch spectroscopy from large surveys to study extreme AGN variability and physics., Comment: Submitted to ApJ. Full tables and figure-sets will be published upon acceptance, and can be made available upon request$.$

Periodic signatures in time-domain observations of quasars have been used to search for binary supermassive black holes. These searches, across existing time-domain surveys, have produced several hundred candidates. The general stochastic variability of quasars, however, can masquerade as a false-positive periodic signal, especially when monitoring cadence and duration are limited. In this work, we predict the detectability of binary supermassive black holes in the upcoming Rubin Observatory Legacy Survey of Space and Time (LSST). We apply computationally inexpensive sinusoidal curve fits to millions of simulated LSST Deep Drilling Field light curves of both single, isolated quasars and binary quasars. Period and phase of simulated binary signals can generally be disentangled from quasar variability. Binary amplitude is overestimated and poorly recovered for two-thirds of potential binaries due to quasar accretion variability. Quasars with strong intrinsic variability can obscure a binary signal too much for recovery. We also find that the most luminous quasars mimic current binary candidate light curves and their properties: false positive rates are 60\% for these quasars. The reliable recovery of binary period and phase for a wide range of input binary LSST light curves is promising for multi-messenger characterization of binary supermassive black holes. However, pure electromagnetic detections of binaries using photometric periodicity with amplitude greater than 0.1 magnitude will result in samples that are overwhelmed by false positives. This paper represents an important and computationally inexpensive way forward for understanding the true and false positive rates for binary candidates identified by Rubin., Comment: 21 pages, 14 figures, 3 tables

This work studies the relationship between accretion-disk size and quasar properties, using a sample of 95 quasars from the SDSS-RM project with measured lags between the $g$ and $i$ photometric bands. Our sample includes disk lags that are both longer and shorter than predicted by the \citet{SS73} model, requiring explanations which satisfy both cases. Although our quasars each have one lag measurement, we explore the wavelength-dependent effects of diffuse broad line region (BLR) contamination through our sample's broad redshift range, $0.1

We present the final data from the Sloan Digital Sky Survey Reverberation Mapping (SDSS-RM) project, a precursor to the SDSS-V Black Hole Mapper Reverberation Mapping program. This data set includes 11-year photometric and 7-year spectroscopic light curves for 849 broad-line quasars over a redshift range of 0.1=0.62+-0.07 for the line dispersion measured from the RMS spectrum. The intrinsic scatter of individual virial factors is 0.31+-0.07 dex, indicating a factor of two systematic uncertainty in RM black hole masses. Our lag measurements reveal significant R-L relations for Hbeta and MgII at high redshift, consistent with the latest measurements based on heterogeneous samples. While we are unable to robustly constrain the slope of the R-L relation for CIV given the limited dynamical range in luminosity, we found substantially larger scatter in CIV lags at fixed L1350. Using the SDSS-RM lag sample, we derive improved single-epoch (SE) mass recipes for Hbeta, MgII and CIV, which are consistent with their respective RM masses as well as between the SE recipes from two different lines, over the luminosity range probed by our sample. The new Hbeta and MgII recipes are approximately unbiased estimators at given RM masses, but there are systematic biases in the CIV recipe. The intrinsic scatter of SE masses around RM masses is ~0.45 dex for Hbeta and MgII, increasing to ~0.58 dex for CIV., Comment: Replaced with accepted version (ApJS in press). All measurements remain unchanged from the previous version. 38 pages. Data products available at https://ariel.astro.illinois.edu/sdssrm/final result/ and ftp://quasar.astro.illinois.edu/public/sdssrm/final_result/

We present a high-cadence multi-epoch analysis of dramatic variability of three broad emission lines (MgII, H$\beta$, and H$\alpha$) in the spectra of the luminous quasar ($\lambda L_{\lambda}$(5100\r{A}) = $4.7 \times 10^{44}$ erg s$^{-1}$) SDSS J141041.25+531849.0 at $z = 0.359$ with 127 spectroscopic epochs over 9 years of monitoring (2013-2022). We observe anti-correlations between the broad emission-line widths and flux in all three emission lines, indicating that all three broad emission lines "breathe" in response to stochastic continuum variations. We also observe dramatic radial velocity shifts in all three broad emission lines, ranging from $\Delta{v}$ $\sim$400 km s$^{-1}$ to $\sim$800 km s$^{-1}$, that vary over the course of the monitoring period. Our preferred explanation for the broad-line variability is complex kinematics in the broad-line region gas. We suggest a model for the broad-line variability that includes a combination of gas inflow with a radial gradient, an azimuthal asymmetry (e.g., a hot spot), superimposed on the stochastic flux-driven changes to the optimal emission region ("line breathing"). Similar instances of line-profile variability due to complex gas kinematics around quasars are likely to represent an important source of false positives in radial velocity searches for binary black holes, which typically lack the kind of high-cadence data we analyze here. The long-duration, wide-field, and many-epoch spectroscopic monitoring of SDSS-V BHM-RM provides an excellent opportunity for identifying and characterizing broad emission-line variability, and the inferred nature of the inner gas environment, of luminous quasars.

The eighteenth data release of the Sloan Digital Sky Surveys (SDSS) is the first one for SDSS-V, the fifth generation of the survey. SDSS-V comprises three primary scientific programs, or "Mappers": Milky Way Mapper (MWM), Black Hole Mapper (BHM), and Local Volume Mapper (LVM). This data release contains extensive targeting information for the two multi-object spectroscopy programs (MWM and BHM), including input catalogs and selection functions for their numerous scientific objectives. We describe the production of the targeting databases and their calibration- and scientifically-focused components. DR18 also includes ~25,000 new SDSS spectra and supplemental information for X-ray sources identified by eROSITA in its eFEDS field. We present updates to some of the SDSS software pipelines and preview changes anticipated for DR19. We also describe three value-added catalogs (VACs) based on SDSS-IV data that have been published since DR17, and one VAC based on the SDSS-V data in the eFEDS field., Comment: Accepted to ApJS

We report the discovery of a new ``changing-look'' active galactic nucleus (CLAGN) event, in the quasar SDSS J162829.17+432948.5 at z=0.2603, identified through repeat spectroscopy from the fifth Sloan Digital Sky Survey (SDSS-V). Optical photometry taken during 2020--2021 shows a dramatic dimming of ${\Delta}$g${\approx}$1 mag, followed by a rapid recovery on a timescale of several months, with the ${\lesssim}$2 month period of rebrightening captured in new SDSS-V and Las Cumbres Observatory spectroscopy. This is one of the fastest CLAGN transitions observed to date. Archival observations suggest that the object experienced a much more gradual dimming over the period of 2011--2013. Our spectroscopy shows that the photometric changes were accompanied by dramatic variations in the quasar-like continuum and broad-line emission. The excellent agreement between the pre- and postdip photometric and spectroscopic appearances of the source, as well as the fact that the dimmest spectra can be reproduced by applying a single extinction law to the brighter spectral states, favor a variable line-of-sight obscuration as the driver of the observed transitions. Such an interpretation faces several theoretical challenges, and thus an alternative accretion-driven scenario cannot be excluded. The recent events observed in this quasar highlight the importance of spectroscopic monitoring of large active galactic nucleus samples on weeks-to-months timescales, which the SDSS-V is designed to achieve., Comment: Published in ApJL

A key challenge for starshades is formation flying. To successfully image exoplanets, the telescope boresight and starshade must be aligned to ~1 m at separations of tens of thousands of kilometers. This challenge has two parts: first, the relative position of the starshade with respect to the telescope must be sensed; and second, sensor measurements must be combined with a control law to keep the two spacecraft aligned in the presence of gravitational and other disturbances. In this work, we present an optical sensing approach using a pupil imaging camera in a 2.4-m telescope that can measure the relative spacecraft bearing to a few centimeters in 1 s, much faster than any relevant dynamical disturbances. A companion paper will describe how this sensor can be combined with a control law to keep the two spacecraft aligned with minimal interruptions to science observations., Comment: 34 pages, 12 Figures, accepted for publication in JATIS