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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.

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All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Mitigating Band Tailing in Kesterite Solar Absorbers: Ab Initio Quantum Dynamics

Open-circuit voltage deficits are limiting factors in kesterite solar cells. Addressing this issue by suppressing band tailing and nonradiative charge recombination is essential for enhancing the performance. We employ ab initio nonadiabatic molecular dynamics to elucidate the origin of band tailing and charge losses and propose a mitigation strategy. The simulations show that Cu–Zn disorder, associated with antisite defect clusters [Cu Zn +Zn Cu ], is a significant source of band tailing in kesterites, as evidenced by the much larger Urbach energy in disordered than ordered kesterites. Cu–Zn disorder gives rise to new sulfur-centered coordination polyhedra, increases structural inhomogeneity, changes electrostatic potential at sulfur centers, and shifts the S(3p) orbital energy. Differences in the S(3p)/Cu(3d) and S(3p)/Sn(5s) hybridization strengths and the S(3p) orbital energy shift reduce the band gap by 0.37 eV. Furthermore, Cu–Zn disorder enhances vibrational motion of sulfur anions and surrounding cations, increasing band gap fluctuations by 15 meV. The stronger electron–phonon interactions reduce charge carrier lifetimes and limit the kesterite solar cell efficiency. Partial substitution of Zn with Cd facilitates structural ordering and significantly suppresses band tailing, particularly in disordered systems. The improvement can be attributed to the larger atomic radius and mass of Cd, which weakens bonding around the anion, suppresses S-related vibrations within the covalent tetrahedra, and reduces nonadiabatic coupling, thereby increasing charge carrier lifetimes. The reported results establish the key influence of cation disorder on band tailing and reduced charge carrier lifetimes in kesterites and highlight cation disorder engineering as a strategy to achieve high-efficiency kesterite solar cells.

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

Where Are White Roofs More Effective in Cooling the Surface?

Solar reflective roofs (also called white or cool roofs) are a common heat mitigation strategy. By reflecting more sunlight than regular roofs, cool roofs experience lower surface temperatures and produce less heating of the surrounding air. The effectiveness of cool roofs, quantified by the surface temperature difference between cool roofs and regular roofs ??????, is known to vary spatially. A common perception is that ?????? is controlled by solar radiation that reaches the roof surface. Here we use an Earth System Model and a surface energy balance model to show that the spatial variability of ??????, when normalized by the albedo difference between cool roofs and regular roofs (????), is in fact more controlled by an energy distribution factor that encodes the efficiencies of surface energy balance components in dissipating heat. Our results suggest that painting the roof white is more effective in reducing the roof surface temperature when the roof has less water holding capacity and smaller thermal admittance and is located in places with more solar radiation, less precipitation, and lower wind speed.

Wang, Linying↗
DOE OSTI2021

Mitigating Injection‐Induced Seismicity Along Basement Faults by Extraction: Application to 2016–2018 Pohang Earthquakes

Abstract The risk of induced earthquake is considered as the major obstacle for sustainable subsurface energy activities. As a mitigation approach, mechanistic risk assessment can be essential to minimize the potential of seismic hazard. Coupled hydro‐mechanical modeling approach is integrated with geomechanical analysis to better assess the occurrence of seismicity induced by injection and/or extraction, which will provide a basis to update operational conditions (e.g., number and location of mitigating wells, rate and duration of operations) for mitigating earthquake nucleation. The Coulomb stability analysis and seismicity rate estimates from this generic study indicate that simultaneous extraction can relieve injection‐induced pore‐pressure buildup, but also transfer and accumulate elastic energy along the faults. Field‐scale simulation with variation in well design for the Pohang EGS site, South Korea, show that multiple wells aligned across a preexisting fault form gradients of pressure and stress fields normal to the fault, which can enhance the direct impact of diffusion process and poroelastic stressing on the fault stability perturbation. Our mechanistic study suggests multiphysics‐oriented mitigation strategies that consider (1) possible mechanical deformation, caused by hydro‐mechanical coupling effects, and (2) proper configuration of well operations based on site‐specific geological characteristics.

Chang, K. W.↗
DOE OSTI2021

Cutover Peat Limits Methane Production Causing Low Emission at a Restored Peatland

Abstract Peatland degradation due to human activities is contributing to rising atmospheric CO 2 levels. Restoring the carbon (C) sink function in degraded peatlands and preventing further stored C losses is a key climate mitigation strategy, given the global scale of peatland disturbance. Active restoration involving a combination of rewetting and vegetation reestablishment at a post‐extraction peatland in Canada has been shown to successfully re‐establish net CO 2 uptake rates similar to undisturbed peatlands within a decade or two. However, lower than expected CH 4 emissions suggest recovery of belowground C cycling processes may lag behind the recovery of the surface net flux. Using closed chamber measurements over a warm season, we determined that restored Sphagnum , which covers two thirds of the site, was a null source of CH 4 . Emissions from the restored site were primarily attributed to vascular plant substrate inputs, measured as acetate, and plant‐mediated transport. The C isotopic fractionation factor for CH 4 and CO 2 in the pore water from the restored former peat field suggested reduced hydrogenotrophic CH 4 production deeper in the cutover peat profile (0.8 m depth). In contrast, isotopic fractionation in the former drainage ditches showed a balance of acetoclastic and hydrogenotrophic methanogenesis deeper in the profile, indicative of some bulk peat C turnover. This study suggests that the legacy of substrate quality in the cutover peat can reduce the climate warming impact of newly restored peatlands through a reduction in CH 4 production and thus emission.

Nugent, Kelly A.↗
DOE OSTI2022

Potential Seismicity Along Basement Faults Induced by Geological Carbon Sequestration

Large-scale CO 2 sequestration into geological formations has been suggested to reduce CO 2 emissions from industrial activities. However, much like enhanced geothermal stimulation and wastewater injection, CO 2 sequestration has a potential to induce earthquake along weak faults, which can be considered a negative impact on safety and public opinion. This research shows the physical mechanisms of potential seismic hazards along basement faults driven by CO 2 sequestration under variation in geological and operational constraints. Specifically we compare the poroelastic behaviors between multiphase flow and single-phase flow cases, highlighting specific needs of evaluating induced seismicity associated with CO 2 sequestration. In contrast to single-phase injection scenario, slower migration of the CO 2 plume than pressure pulse may delay accumulation of pressure and stress along basement faults that may not be mitigated immediately by shut-in of injection. The impact of multiphase flow system, therefore, needs to be considered for proper monitoring and mitigation strategies.

58 GEOSCIENCES↗
DOE OSTI2022

Matrix Approach to Land Carbon Cycle Modeling

Land ecosystems contribute to climate change mitigation by taking up approximately 30% of anthropogenically emitted carbon. However, estimates of the amount and distribution of carbon uptake across the world's ecosystems or biomes display great uncertainty. The latter hinders a full understanding of the mechanisms and drivers of land carbon uptake, and predictions of the future fate of the land carbon sink. The latter is needed as evidence to inform climate mitigation strategies such as afforestation schemes. To advance land carbon cycle modeling, we have developed a matrix approach. Land carbon cycle models use carbon balance equations to represent carbon exchanges among pools. Our approach organizes this set of equations into a single matrix equation without altering any processes of the original model. The matrix equation enables the development of a theoretical framework for understanding the general, transient behavior of the land carbon cycle. While carbon input and residence time are used to quantify carbon storage capacity at steady state, a third quantity, carbon storage potential, integrates fluxes with time to define dynamic disequilibrium of the carbon cycle under global change. The matrix approach can help address critical contemporary issues in modeling, including pinpointing sources of model uncertainty and accelerating spin-up of land carbon cycle models by tens of times. The accelerated spin-up liberates models from the computational burden that hinders comprehensive parameter sensitivity analysis and assimilation of observational data to improve model accuracy. Such computational efficiency offered by the matrix approach enables substantial improvement of model predictions using ever-increasing data availability. Overall, the matrix approach offers a step change forward for understanding and modeling the land carbon cycle.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Environmental Co‐Benefits of Maintaining Native Vegetation With Solar Photovoltaic Infrastructure

Abstract Co‐locating solar photovoltaics with vegetation could provide a sustainable solution to meeting growing food and energy demands. However, studies quantifying multiple co‐benefits resulting from maintaining vegetation at utility‐scale solar power plants are limited. We monitored the microclimate, soil moisture, panel temperature, electricity generation and soil properties at a utility‐scale solar facility in a continental climate with different site management practices. The compounding effect of photovoltaic arrays and vegetation may homogenize soil moisture distribution and provide greater soil temperature buffer against extreme temperatures. The vegetated solar areas had significantly higher soil moisture, carbon, and other nutrients compared to bare solar areas. Agrivoltaics in agricultural areas with carbon debt can be an effective climate mitigation strategy along with revitalizing agricultural soils, generating income streams from fallow land, and providing pollinator habitats. However, the benefits of vegetation cooling effects on electricity generation are rather site‐specific and depend on the background climate and soil properties. Overall, our findings provide foundational data for site preservation along with targeting site‐specific co‐benefits, and for developing climate resilient and resource conserving agrivoltaic systems.

14 SOLAR ENERGY↗
DOE OSTI2024

Land Use Change Alters Soil Organic Carbon: Constrained Global Patterns and Predictors

Abstract Land use change (LUC) alters the global carbon (C) stock, but our estimation of the alteration remains uncertain and is a major impediment to predicting the global C cycle. The uncertainty is partly due to the limited number and geographical bias of observations, and limited exploration of its predictors. Here we generated a comprehensive global database of 5,980 observations from 790 articles. The number of sites evaluated is at least seven times larger than in previous meta‐analyses. Our constrained estimates of different LUC's effects on soil organic C (SOC) and their variations across global climates reveal underestimation/overestimation in previous estimates. Converting forests and grasslands to croplands reduced SOC by 24.5% ± 1.53% (−11.03 ± 1.06 Mg ha −1 ) and 22.7% ± 1.22% (−8.09 ± 0.67 Mg ha −1 ), while 28.0% ± 1.56% (4.46 ± 0.42 Mg ha −1 ) and 33.5% ± 1.68% (5.8 ± 0.38 Mg ha −1 ) increases, respectively, were obtained in the reverse processes. Converting forests to grasslands decreased SOC by 2.1% ± 1.22% (−1.13 ± 0.44 Mg ha −1 ), while the reverse process increased SOC by 18.6% ± 1.73% (3.31 ± 0.51 Mg ha −1 ). Modeled relative importance of 10 drivers of LUC's impact on SOC revealed that higher initial SOC (iSOC) does not solely determine SOC loss in SOC‐negative LUC scenarios as previously proposed. Across four decades, reconverting croplands to forests and grasslands recovered only 49.5% (6.1 ± 0.51 Mg ha −1 ) and 75.3% (7.0 ± 0.38 Mg ha −1 ) of the iSOC, respectively, indicating the need for protecting C‐rich ecosystems. Our global data set advances information on LUC's effect on SOC and can be valuable to constrain Earth system models to reliably estimate global SOC stocks and plan climate change mitigation strategies.

Environmental Sciences & Ecology↗
DOE OSTI2024

Forest Carbon Storage in the Western United States: Distribution, Drivers, and Trends

Abstract Forests are a large carbon sink and could serve as natural climate solutions that help moderate future warming. Thus, establishing forest carbon baselines is essential for tracking climate‐mitigation targets. Western US forests are natural climate solution hotspots but are profoundly threatened by drought and altered disturbance regimes. How these factors shape spatial patterns of carbon storage and carbon change over time is poorly resolved. Here, we estimate live and dead forest carbon density in 19 forested western US ecoregions with national inventory data (2005–2019) to determine: (a) current carbon distributions, (b) underpinning drivers, and (c) recent trends. Potential drivers of current carbon included harvest, wildfire, insect and disease, topography, and climate. Using random forests, we evaluated driver importance and relationships with current live and dead carbon within ecoregions. We assessed trends using linear models. Pacific Northwest (PNW) and Southwest (SW) ecoregions were most and least carbon dense, respectively. Climate was an important carbon driver in the SW and Lower Rockies. Fire reduced live and increased dead carbon, and was most important in the Upper Rockies and California. No ecoregion was unaffected by fire. Harvest and private ownership reduced carbon, particularly in the PNW. Since 2005, live carbon declined across much of the western US, likely from drought and fire. Carbon has increased in PNW ecoregions, likely recovering from past harvest, but recent record fire years may alter trajectories. Our results provide insight into western US forest carbon function and future vulnerabilities, which is vital for effective climate change mitigation strategies.

Environmental Sciences & Ecology↗
DOE OSTI2023

Contrasting Trends and Drivers of Global Surface and Canopy Urban Heat Islands

A comprehensive comparison of the trends and drivers of global surface and canopy urban heat islands (termed / s and / c trends, respectively) is critical for better designing urban heat mitigation strategies. However, such a global comparison remains largely absent. Using spatially continuous land surface temperatures and surface air temperatures (2003–2020), here we find that the magnitude of the global mean / s trend (0.19 ± 0.006°C/decade, mean ± SE) for 5,643 cities worldwide is nearly six-times the corresponding / c trend (0.03 ± 0.002°C/decade) during the day, while the former (0.06 ± 0.004°C/decade) is double the latter (0.03 ± 0.002°C/decade) at night. Variable importance scores indicate that global daytime / s trend is slightly more controlled by surface property, while background climate plays a more dominant role in regulating global daytime / c trend. At night, both global / s and / c trends are mainly controlled by background climate.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2024

Aerosol-Cloud Interactions From Aviation Soot Emissions

Current models estimate global aviation contributes approximately 5% to the total anthropogenic climate forcing, with aerosol-cloud interactions having the greatest effect. However, radiative forcing estimates from aviation aerosol-cloud interactions remain undetermined. There is an expected significant increase in aircraft emissions with aviation demand expected to rise by over 4% per year. Soot may play an important role in the ice nucleation of aircraft-induced cirrus formation due to a high emission rate, but the ice nucleating properties are poorly constrained. Understanding the microphysical processes leading to atmospheric ice crystal formation is crucial for the reliable parameterization of aerosol-cloud interactions in climate models due to their impact on precipitation and cloud radiative properties. Ice nucleation of aircraft-emitted soot is potentially affected by particle morphology with condensation of supercooled water occurring in pores followed by ice nucleation. However, soot has heterogeneous properties and undergoes atmospheric aging and oxidation that could change surface properties and contribute to complex ice nucleation processes. Further, this review synthesizes current knowledge of ice nucleation catalyzed by aviation in the cirrus regime and its effects on global radiative forcing. Further research is required to determine the ice nucleation and microphysical processes of cirrus cloud formation from aviation emissions in both controlled laboratory and field investigations to inform models for more accurate climate predictions and to provide efficient mitigation strategies.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2024

Nutrient Replenishment by Turbulent Mixing in Suspended Macroalgal Farms

Abstract This study uses large eddy simulations to investigate nutrient transport and uptake in suspended macroalgal farms. Various farm configurations and oceanic forcing conditions are examined, with the farm base located near the nutricline depth. We introduce the Damkohler number Da to quantify the balance between nutrient consumption by macroalgae uptake and supply by farm‐enhanced nutrient transport. Most cases exhibit low Da , indicating that farm‐generated turbulence drives sufficient upward nutrient fluxes, supporting macroalgae growth. High Da and starvation may occur in fully grown farm blocks, a configuration that generates the weakest turbulence, particularly when combined with densely planted macroalgae or weak flow conditions. Flow stagnation within the farm due to macroalgae drag may constrain the uptake efficiency and further increase the starvation risk. Mitigation strategies involve timely harvesting, avoiding dense macroalgae canopies, and selecting farm locations with robust ocean currents and waves. This study provides insights for sustainable macroalgal farm planning.

Geology↗
DOE OSTI2026

The Baltimore Community Weather Station Network: Filling the Urban Measurement Desert

Quantification and understanding of how heat, rainfall, and air quality vary within cities are needed to identify the area with the worst conditions, develop solutions to extreme weather, and assess the impact of proposed policies. However, neighborhood-level variability is not well quantified because there are few environmental measurement stations within cities. In Baltimore City, a community-based network of weather stations to address this issue has been developed through a partnership between universities, state agencies, and Baltimore residents. The weather stations are hosted by community partners, and the data collected are enabling the mapping of urban weather across the city and the testing of models and proposed mitigation strategies. In addition, the network provides direct community involvement, with resulting benefits of increased community engagement, education, and empowerment. Researchers have an opportunity to democratize the scientific process and ensure that local knowledge and lived experiences of city residents inform future decision-making. The approach could be used as a model for other cities that apply similar monitoring instruments for other environmental exposures.

community↗
DOE OSTI2020

Accelerated dryland expansion regulates future variability in dryland gross primary production

Drylands cover 41% of the Earth’s land surface and are the largest source of interannual variability in the global carbon sink. While drylands are projected to experience an accelerated expansion over the next century, the implications of this expansion and degradation for variability in their gross primary production (GPP) remain elusive. Here we show that total dryland GPP by 2100 will increase by 12 ± 3% relative to the 2010–2014 baseline. Because drylands will largely expand into formerly more productive ecosystems, this increase in dryland GPP may not increase total global GPP. Further, GPP per unit dryland area will decrease as degradation of historical drylands outpaces the higher GPP of expanded drylands. Dryland expansion and climate-induced conversions among sub-humid, semi-arid, arid, and hyper-arid subtypes will lead to substantial changes in regional and subtype contributions to global dryland GPP variability. Our results highlight the vulnerability of dryland subtypes to more frequent and severe climate extremes and suggest that strong regional variations will require different mitigation strategies in different regions.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Machine learning-based observation-constrained projections reveal elevated global socioeconomic risks from wildfire

Reliable projections of wildfire and associated socioeconomic risks are crucial for the development of efficient and effective adaptation and mitigation strategies. The lack of or limited observational constraints for modeling outputs impairs the credibility of wildfire projections. Here, we present a machine learning framework to constrain the future fire carbon emissions simulated by 13 Earth system models from the Coupled Model Intercomparison Project phase 6 (CMIP6), using historical, observed joint states of fire-relevant variables. During the twenty-first century, the observation-constrained ensemble indicates a weaker increase in global fire carbon emissions but higher increase in global wildfire exposure in population, gross domestic production, and agricultural area, compared with the default ensemble. Such elevated socioeconomic risks are primarily caused by the compound regional enhancement of future wildfire activity and socioeconomic development in the western and central African countries, necessitating an emergent strategic preparedness to wildfires in these countries.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Pacific decadal oscillation causes fewer near-equatorial cyclones in the North Indian Ocean

Tropical cyclones do not form easily near the equator but can intensify rapidly, leaving little time for preparation. We investigate the number of near-equatorial (originating between 5°N and 11°N) tropical cyclones over the north Indian Ocean during post-monsoon season (October to December) over the past 60 years. The study reveals a marked 43% decline in the number of such cyclones in recent decades (1981–2010) compared to earlier (1951–1980). Here, we show this decline in tropical cyclone frequency is primarily due to the weakened low-level vorticity modulated by the Pacific Decadal Oscillation (PDO) and increased vertical wind shear. In the presence of low-latitude basin-wide warming and a favorable phase of the PDO, both the intensity and frequency of such cyclones are expected to increase. Such dramatic and unique changes in tropical cyclonic activity due to the interplay between natural variability and climate change call for appropriate planning and mitigation strategies.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Aldehyde cool-flame chemistry explains a missing source of organic acids

Combustion emission is a significant source of organic acids, impacting atmospheric chemistry and climate. Their formation mechanisms, however, remain poorly understood, leading to underestimation in kinetic models. We investigate the cool-flame oxidation of key combustion intermediates—C 1 –C 4 aldehydes and benzaldehyde. Using in-situ synchrotron vacuum ultraviolet photoionization mass spectrometry, we observe the direct conversion of aldehydes to organic acids, a process enhanced by HO 2 radicals. Quantum chemistry calculations reveal that the reaction of RC(O)O 2 with HO 2 on the singlet potential energy surface contributes to organic acids. Incorporating this pathway into a kinetic model significantly improves organic acid prediction. Despite the high-temperature nature of engine combustion, significant spatial and temporal inhomogeneities (e.g., near-wall regions and crevice volumes) lead to localized cool-flame conditions, facilitating organic acid formation and emission. Elucidating the acid formation under cool-flame conditions provides a critical mechanism for accurately modelling anthropogenic organic acid emissions and developing mitigation strategies.

SVUV-PIMS↗
DOE OSTI2025

Analysis of biofilm assembly by large area automated AFM

Biofilms are complex microbial communities critical in medical, industrial, and environmental contexts. Understanding their assembly, structure, genetic regulation, interspecies interactions, and environmental responses is key to developing effective control and mitigation strategies. While atomic force microscopy (AFM) offers critically important high-resolution insights on structural and functional properties at the cellular and even sub-cellular level, its limited scan range and labor-intensive nature restricts the ability to link these smaller scale features to the functional macroscale organization of the films. We begin to address this limitation by introducing an automated large area AFM approach capable of capturing high-resolution images over millimeter-scale areas, aided by machine learning for seamless image stitching, cell detection, and classification. Large area AFM is shown to provide a very detailed view of spatial heterogeneity and cellular morphology during the early stages of biofilm formation which were previously obscured. Using this approach, we examined the organization of Pantoea sp. YR343 on PFOTS-treated glass surfaces. Our findings reveal a preferred cellular orientation among surface-attached cells, forming a distinctive honeycomb pattern. Detailed mapping of flagella interactions suggests that flagellar coordination plays a role in biofilm assembly beyond initial attachment. Additionally, we use large-area AFM to characterize surface modifications on silicon substrates, observing a significant reduction in bacterial density. This highlights the potential of this method for studying surface modifications to better understand and control bacterial adhesion and biofilm formation.

59 BASIC BIOLOGICAL SCIENCES↗