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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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DOE OSTI2021

Multiple Indicators of Extreme Changes in Snow-Dominated Streamflow Regimes, Yakima River Basin Region, USA

Snow plays a major role in the hydrological cycle. Variations in snow duration and timing can have a negative impact on water resources. Excluding predicted changes in snowmelt rates and amounts could result in deleterious infrastructure, military mission, and asset impacts at military bases across the US. A change in snowpack can also lead to water shortages, which in turn can affect the availability of irrigation water. We performed trend analyses of air temperature, snow water equivalent (SWE) at 22 SNOTEL stations, and streamflow extremes for selected rivers in the snow-dependent and heavily irrigated Yakima River Basin (YRB) located in the Pacific Northwest US. There was a clear trend of increasing air temperature in this study area over a 30 year period (water years 1991–2020). All stations indicated an increase in average air temperatures for December (0.97 °C/decade) and January (1.12 °C/decade). There was also an upward trend at most stations in February (0.28 °C/decade). In December–February, the average air temperatures were 0.82 °C/decade. From these trends, we estimate that, by 2060, the average air temperatures for December–February at most (82%) stations will be above freezing. Furthermore, analysis of SWE from selected SNOTEL stations indicated a decreasing trend in historical SWE, and a shift to an earlier peak SWE was also assumed to be occurring due of the shorter snow duration. Decreasing trends in snow duration, rain-on-snow, and snowmelt runoff also resulted from snow modeling simulations of the YRB and the nearby area. We also observed a shift in the timing of snowmelt-driven peak streamflow, as well as a statistically significant increase in winter maximum streamflow and decrease in summer maximum and minimum streamflow trends by 2099. From the streamflow trends and complementary GEV analysis, we show that the YRB basin is a system in transition with earlier peak flows, lower snow-driven maximum streamflow, and higher rainfall-driven summer streamflow. This study highlights the importance of looking at changes in snow across multiple indicators to develop future infrastructure and planning tools to better adapt and mitigate changes in extreme events.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2021

Integrating computation and experiment to investigate photoelectrodes for solar water splitting at the microscopic scale.

CONSPECTUS: Photoelectrochemical water-splitting is a promising and sustainable way to store the energy of the sun in chemical bonds and use it to produce hydrogen gas, a clean fuel. The key components in photoelectrochemical cells (PECs) are photoelectrodes, including a photocathode that reduces water to hydrogen gas and a photoanode that oxidizes water to oxygen gas. Materials used in photoelectrodes for PECs must effectively absorb sunlight, yield photogenerated carriers, and exhibit electronic properties that enable the efficient shuttling of carriers to the surface to participate in relevant water-splitting reactions. Discovering and understanding the key characteristics of optimal photoelectrode materials is paramount to the realization of PEC technologies. Oxide-based photoelectrodes can satisfy many of these materials requirements, including stability in aqueous environments, band edges with reasonable alignment with the redox potentials for water splitting, and ease of synthesis. However, oxide photoelectrodes generally suffer from poor charge transport properties and considerable bulk electron-hole separation, and they have relatively large band gaps. Numerous strategies have been proposed to improve these aspects and understand how these improvements are reflected in the photoelectrochemical performance. Unfortunately, the structural and compositional complexity of multinary oxides accompanied by the inherent complexity of photoelectrochemical processes makes it challenging to understand the individual effects of composition, structure, and defects in the bulk and on the surface on a material's photoelectrochemical properties. The integration of experiment and theory has great potential to increase our atomic-level understanding of structure-composition-property relationships in oxide photoelectrodes. In this Account, we describe how integrating experiment and theory is beneficial for achieving scientific insights at the microscopic scale. We highlight studies focused on understanding the role of (i) bulk composition via solid-state solutions, intercalation, and comparison with isoelectronic compounds, (ii) dopants for both the anion and cation and their interactions with oxygen vacancies, and (iii) surface/interface structure in the photocurrent generation and photoelectrochemical performance in oxide photoelectrodes. In each instance, we outline strategies and considerations for integrating experiment and theory and describe how this integration led to valuable insights and new directions in uncovering structure-composition-property relationships. Our aim is to demonstrate the unique value of combining experiment and theory in studying photoelectrodes and to encourage the continued effort to bring experiment and theory in closer step with each other.

Wang, Wennie↗