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DOE OSTI2023

Impact of Ural Blocking on Early Winter Climate Variability Under Different Barents‐Kara Sea Ice Conditions

Abstract Ural blocking (UB) is a prominent mode of variability of the Northern Hemisphere atmospheric circulation, particularly in fall. It can persist for several days and exert a lagged influence on the wintertime NH circulation, providing predictability at the subseasonal time scale. Using two atmospheric models, we explore how the early winter atmospheric circulation responds to a 2‐week persistent UB anomaly imposed in early November. Experiments are carried out with two different configurations of Barents‐Kara (BK) sea‐ice concentration to examine whether it plays a role in how UB impacts atmospheric variability. In both models, the UB anomaly is followed by a weakening of the stratospheric polar vortex and a negative phase of the North Atlantic Oscillation (NAO), which lasts up to 2 months after the forcing is released. Interestingly, the response is more persistent under low BK sea‐ice conditions, that is, BK sea ice modulates the atmospheric response to UB. Additional experiments with prescribed sea ice concentration anomalies alone suggest that BK sea ice exerts a limited influence on early winter NH atmospheric variability. The response to UB involves a weakening of the polar vortex that persists longer under low BK sea ice, which explains the more persistent response in that configuration. Our study highlights that UB variability in November is a robust precursor for early winter NAO/polar stratosphere anomalies, and this may be more relevant in the context of declining Arctic sea‐ice extent. Provided that climate models accurately capture this teleconnection, it has the potential to improve subseasonal predictions of the NH wintertime climate.

Meteorology & Atmospheric Sciences↗

DOE OSTI2021

Oineus v1.0

A library for multi-threaded computation of persistence diagrams. The algorithm for computing persistence diagrams in a lock-free manner was published in the 'Towards Lock-free Persistent Homology' (D. Morozov, A. Nigmetov, Brief Announcement: SPAA 2020); it scales better than the only other shared-memory parallel implementation of persistent homology computation PHAT. Library includes python bindings to compute persistence diagrams and their vectorizations for lower-star filtrations on grid data. It is intended to be used by scientists working on Topological Data Analysis and its applications in different areas.

Nigmetov, Arnur↗

DOE OSTI2024

The ECP SICM project: Managing complex memory hierarchies for exascale applications

The Exascale Computing Project (ECP)’s Simplified Interface to Complex Memories (SICM) effort focuses on developing universal interfaces for discovering, managing, and sharing data across complex memory hierarchies. These facilitate the exploitation of emerging memory technologies and support precise control over their various trade-offs such as high-bandwidth versus low-latency, persistent versus ephemeral, high-capacity versus low-capacity, and near-CPU versus near-GPU. SICM comprises three interrelated components: a low-level interface, a high-level interface, and a persistent-heap interface. The low-level SICM interface is intended for system and run-time developers as well as expert application developers who prefer full control of the memory objects used within their application. The high-level SICM interface builds upon the low-level interface, employing application-level profiling and analysis to optimize data management for complex memory hierarchies. The persistent-heap interface provides applications with a persistent memory allocator that can allocate custom C++ data structures in both block-storage and byte-addressable persistent memories.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2021

Precipitation Characteristics of Warm Season Weather Types in the Southeastern United States of America

Daily weather types (WTs) over the Southeast United States have been analyzed using 850 hPa winds from reanalysis data from March to October of 1979–2019. Six WTs were obtained. WTs 1–3 represent mid-latitude synoptic systems propagating eastward. WT4 is a summer-type pattern predominantly occurring in June–August, with the center of the North Atlantic Subtropical High (NASH) along the Gulf coast in the southern United States. WT5 is most frequent from August to middle October, with the NASH pushed further north and southerly winds over the northern Great Plains. An anticyclone centered at the Carolina coast characterizes WT6, which occurs in all months but is slightly more frequent in the spring and fall, especially in October, corresponding to fair weather in the region. WTs 1, 2 and 3 can persist for only a few days. WTs 4, 5 and 6 can have long spells of persistence. Besides self-persistence, the most observed progression loop is WT1 to WT2, to WT3, and then back to WT1, corresponding to eastward-propagating waves. WTs 4 and 5 are likely to show persistence, with long periods of consecutive days. WT6 usually persists but can also transfer to WT3, i.e., a change from fair weather in the Southeast U.S. to rainy weather in the Mississippi River Valley. A diurnal cycle of precipitation is apparent for each WT, especially over coastal plains. The nocturnal precipitation in central U.S. is associated with WT3. WTs 1–3 are more frequent in El Niño years, corresponding to stronger westerly wave activities and above normal rainfall in the Southeast U.S. in the spring. The positive rainfall anomaly in the Mississippi and Ohio River valley in El Niño years is also associated with more frequent WT3.

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS1994

Contrasting conditions of surface water balance in wet years and dry years as a possible land surface-atmosphere feedback mechanism in the West African Sahel

The climate of West Africa, in particular the Sahel, is characterized by multiyear persistence of anomalously wet or dry conditions. Its Southern Hemisphere counterpart, the Kalahari, lacks the persistence that is evident in the Sahel even though both regions are subject to similar large-scale forcing. It has been suggested that land surface-atmosphere feedback contributes to this persistence and to the severity of drought. In this study, surface energy and water balance are quantified for nine stations along a latitudinal transect that extends from the Sahara to the Guinea coast. In the wetter regions of West Africa, the difference between wet and dry years is primarily reflected in the magnitude of runoff. For the Sahel and drier locations, evapotranspiration and soil moisture are more sensitive to rainfall anomalies. The increase in evapotranspiration, and hence latent heating, over the Sahel in wet years alters the thermal structure and gradients of the overlying atmosphere and thus the strength of the African easterly jet (AEJ) at 700 mb. The difference between dry and wet Augusts corresponds to a decrease in magnitude of the AEJ at 15 deg N on the order of 2.6 m/s, which is consistent with previous studies of observed winds. Spatial patterns were also developed for surface water balance parameters for both West Africa and southern Africa. Over southern Africa, the patterns are not as spatially homogeneous as those over West Africa and are lower in magnitude, thus supporting the suggestion that the persistence of rainfall anomalies in the Sahel might be due, at least in part, to land-atmosphere feedback, and that the absence of such persistence in the Kalahari is a consequence of less significant changes in surface water and energy balance.

Lare, A. R.↗

NASA NTRS2010

Aircraft Trajectory Optimization and Contrails Avoidance in the Presence of Winds

There are indications that persistent contrails can lead to adverse climate change, although the complete effect on climate forcing is still uncertain. A flight trajectory optimization algorithm with fuel and contrails models, which develops alternative flight paths, provides policy makers the necessary data to make tradeoffs between persistent contrails mitigation and aircraft fuel consumption. This study develops an algorithm that calculates wind-optimal trajectories for cruising aircraft while avoiding the regions of airspace prone to persistent contrails formation. The optimal trajectories are developed by solving a non-linear optimal control problem with path constraints. The regions of airspace favorable to persistent contrails formation are modeled as penalty areas that aircraft should avoid and are adjustable. The tradeoff between persistent contrails formation and additional fuel consumption is investigated, with and without altitude optimization, for 12 city-pairs in the continental United States. Without altitude optimization, the reduction in contrail travel times is gradual with increase in total fuel consumption. When altitude is optimized, a two percent increase in total fuel consumption can reduce the total travel times through contrail regions by more than six times. Allowing further increase in fuel consumption does not seem to result in proportionate decrease in contrail travel times.

Ng, Hok K.↗

NASA NTRS2010

Concepts and Challenges for Environmentally Friendly En Route Operations

A flight trajectory optimization algorithm with fuel and contrails models, which develops alternative flight paths, provides policy makers the necessary data to make tradeoffs between persistent contrails mitigation and aircraft fuel consumption. This study develops an algorithm that calculates wind-optimal trajectories for cruising aircraft while avoiding the regions of airspace prone to persistent contrails formation. The optimal trajectory is derived using Singular Perturbation Method. The regions of airspace favorable to persistent contrails formation are modeled as high-risk areas that aircraft should avoid and are adjustable. The tradeoffs between persistent contrails formation and additional travel time are investigated for wind-optimal trajectories and various contrails-avoidance trajectories at 10 different cruising altitudes for flights departing from Chicago and San Diego to New York. The additional travel times required for avoiding 100% persistent contrails formation at various flight altitudes ranged from approximately 0% to 4.3% for flights from Chicago to New York. For flights between San Diego and New York, additional traveling times vary between 1.3% and 5% depending on the cruise altitude and the percentage of contrail avoidance. Talk will present the results of aircraft fuel consumptions that are proportional to the travel time for cruising aircraft.

Sridhar, Banavar↗

NASA NTRS2015

Evaluation of a Model-Based Groundwater Drought Indicator in the Conterminous U.S.

Monitoring groundwater drought using land surface models is a valuable alternative given the current lack of systematic in situ measurements at continental and global scales and the low resolution of current remote sensing based groundwater data. However, uncertainties inherent to land surface models may impede drought detection, and thus should be assessed using independent data sources. In this study, we evaluated a groundwater drought index (GWI) derived from monthly groundwater storage output from the Catchment Land Surface Model (CLSM) using a GWI similarly derived from in situ groundwater observations. Groundwater observations were obtained from unconfined or semi-confined aquifers in eight regions of the central and northeastern U.S. Regional average GWI derived from CLSM exhibited strong correlation with that from observation wells, with correlation coefficients between 0.43 and 0.92. GWI from both in situ data and CLSM was generally better correlated with the Standard Precipitation Index (SPI) at 12 and 24 month timescales than at shorter timescales, but it varied depending on climate conditions. The correlation between CLSM derived GWI and SPI generally decreases with increasing depth to the water table, which in turn depends on both bedrock depth (a CLSM parameter) and mean annual precipitation. The persistence of CLSM derived GWI is spatially varied and again shows a strong influence of depth to groundwater. CLSM derived GWI generally persists longer than GWI derived from in situ data, due at least in part to the inability of coarse model inputs to capture high frequency meteorological variability at local scales. The study also showed that groundwater can have a significant impact on soil moisture persistence where the water table is shallow. Soil moisture persistence was estimated to be longer in the eastern U.S. than in the west, in contrast to previous findings that were based on models that did not represent groundwater. Assimilation of terrestrial water storage data from the Gravity Recovery and Climate Experiment (GRACE) satellite mission improved the correlation between CLSM based regional average GWI and that based on in situ data in six of the eight regions. Practical issues regarding the application of GRACE assimilated groundwater storage for drought detection are discussed. An important conclusion of this study is that model parameters that control the depth to the water table, including bedrock depth, strongly influence the evolution and persistence of simulated groundwater and require careful configuration for drought monitoring.

Evaluation↗

NASA NTRS2014

Evaluation of a Model-Based Groundwater Drought Indicator in the Conterminous U.S.

hydrology↗

NASA NTRS2022

Ambiguous Stability of Glaciers at Bed Peaks

Increasing ice flux from glaciers retreating over deepening (retrograde) bed topography has been implicated in the recent acceleration of mass loss from the Greenland and Antarctic ice sheets. We show in observations that some glaciers have remained at peaks in bed topography without retreating despite enduring significant changes in climate. Observations also indicate that some glaciers which persist at bed peaks undergo sudden retreat years or decades after the onset of local ocean or atmospheric warming. Using model simulations, we show that persistence of a glacier at a bed peak is caused by ice slowing as it flows up a reverse-sloping bed to the peak. Persistence at bed peaks may lead to two very different future behaviors for a glacier: one where it persists at a bed peak indefinitely, and another where it retreats from the bed peak after potentially long delays following climate forcing. However, it is nearly impossible to distinguish which of these two future behaviors will occur from current observations. We conclude that inferring glacier stability from observations of persistence obscures our true commitment to future sea-level rise under climate change. We recommend that further research is needed on seemingly stable glaciers to determine their likely future.

ice dynamics↗

DOE OSTI2023

A Vision for Coupling Operation of US Fusion Facilities with HPC Systems and the Implications for Workflows and Data Management

The operation of large US Department of Energy (DOE) research facilities, like the DIII-D National Fusion Facility, results in the collection of complex multi-dimensional scientific datasets, both experimental and model-generated. In the future, it is envisioned that integrated data analysis coupled with large-scale high performance computing (HPC) simulations will be used to improve experimental planning and operation. Practically, massive data sets from these simulations provide the physics basis for generation of both reduced semi-analytic and machine-learning-based models. Storage of both HPC simulation datasets (generated from US DOE leadership computing facilities) and experimental datasets presents significant challenges. In this paper, we present a vision for a DOE-wide data management workflow that integrates US DOE fusion facilities with leadership computing facilities. Data persistence and long-term availability beyond the length of allocated projects is essential, particularly for verification and recalibration of artificial intelligence and machine learning (AI/ML) models. Because these data sets are often generated and shared among hundreds of users across multiple leadership computing facility centers, they would benefit from cross-platform accessibility, persistent identifiers (e.g. DOI, or digital object identifier), and provenance tracking. Here, the ability to handle different data access patterns suggests that a combination of low cost, high latency (e.g. for storing ML training sets) and high cost, low latency systems (e.g. for real-time, integrated machine control feedback) may be needed.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2021

Evaluation of overtime phenotypic variation of yeasts in chronic vulvovaginal candidosis cases

Abstract Chronic vulvovaginal candidosis results either from reinfection or from the ability of Candida spp. to persist in the vulva and/or vagina. Persistence is usually associated with increased antifungal (mainly azoles) resistance rates, which can explain treatment failure, and/or increased expression of virulence factors by Candida spp. The aim of this study was to assess the mechanisms leading to Candida spp persistence, by studying sequential isolates from women with chronic vulvovaginal candidosis, focusing on strains genotypes, azole resistance, and ability to form biofilms along the period of clinical evaluation. The strains were identified at species level by automated analysis of biochemical profiles and molecular typing evaluated by polymorphic DNA analysis. The capacity to form biofilm was assessed with a microtiter plate assay. Fluconazole susceptibility was determined by the microdilution broth assay at both pH 7 (following the recommended guideline) and pH 4.5 (as representative of vaginal pH). We studied samples from 17 clinically recurrent cases. In 53% of the chronic cases there were two or more isolates that had a phylogenetic relationship while the remaining (47%) were caused by different species. In those cases where related strains were involved in recurrence, we verified an increase in MIC at pH 7 and also an increased capacity to form biofilms over time. Significant correlation between these two parameters was observed only in cases caused by C. glabrata, evidencing the importance of these two factors to enhance persistence in the vaginal mucosa for this particular species.

Faria-Gonçalves, Paula↗

DOE OSTI2022

Global decline in ocean memory over the 21st century

Ocean memory, the persistence of ocean conditions, is a major source of predictability in the climate system beyond weather time scales. We show that ocean memory, as measured by the year-to-year persistence of sea surface temperature anomalies, is projected to steadily decline in the coming decades over much of the globe. This global decline in ocean memory is predominantly driven by shoaling of the upper-ocean mixed layer depth in response to global surface warming, while thermodynamic and dynamic feedbacks can contribute substantially regionally. As the mixed layer depth shoals, stochastic forcing becomes more effective in driving sea surface temperature anomalies, increasing high-frequency noise at the expense of persistent signals. Reduced ocean memory results in shorter lead times of skillful persistence-based predictions of sea surface thermal conditions, which may present previously unknown challenges for predicting climate extremes and managing marine biological resources under climate change.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2021

Nonlinear Response of Atmospheric Blocking to Early Winter Barents–Kara Seas Warming: An Idealized Model Study

Wintertime Ural blocking (UB) has been shown to play an important role in cold extremes over Eurasia, and thus it is useful to investigate the impact of warming over the Barents–Kara Seas (BKS) on the behavior of Ural blocking. In our study the response of UB to stepwise tropospheric warming over the BKS is examined using a dry dynamic core model. Nonlinear responses are found in the frequency and local persistence of UB. The frequency and local persistence of the UB increase with the strength of BKS warming in a less strong range and decrease with the further increase of BKS warming, which is linked to the UB propagation influenced by upstream background atmospheric circulation. For a weak BKS warming, the UB becomes more persistent due to its less westward movement associated with intensified upstream zonal wind and meridional potential vorticity gradient (PVy) in the North Atlantic mid-high latitudes, which corresponds to a negative height response over the North Atlantic high latitudes. When BKS warming is strong, a positive height response appears in the early winter stratosphere, and its subsequent downward propagation leads to a negative NAO response or increased Greenland blocking events, which reduces zonal wind and PVy in the high latitudes from North Atlantic to Europe, thus enhancing the westward propagation of UB and reducing its local persistence. The transition to the negative NAO phase and the retrogression of UB are not found when numerically suppressing the downward influence of weakened stratospheric polar vortex, suggesting a crucial role of the stratospheric pathway in nonlinear responses of UB to the early winter BKS warming.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2023

Reverse-zoonoses of 2009 H1N1 pandemic influenza A viruses and evolution in United States swine results in viruses with zoonotic potential

The 2009 H1N1 pandemic (pdm09) lineage of influenza A virus (IAV) crosses interspecies barriers with frequent human-to-swine spillovers each year. These spillovers reassort and drift within swine populations, leading to genetically and antigenically novel IAV that represent a zoonotic threat. We quantified interspecies transmission of the pdm09 lineage, persistence in swine, and identified how evolution in swine impacted zoonotic risk. Human and swine pdm09 case counts between 2010 and 2020 were correlated and human pdm09 burden and circulation directly impacted the detection of pdm09 in pigs. However, there was a relative absence of pdm09 circulation in humans during the 2020–21 season that was not reflected in swine. During the 2020–21 season, most swine pdm09 detections originated from human-to-swine spillovers from the 2018–19 and 2019–20 seasons that persisted in swine. We identified contemporary swine pdm09 representatives of each persistent spillover and quantified cross-reactivity between human seasonal H1 vaccine strains and the swine strains using a panel of monovalent ferret antisera in hemagglutination inhibition (HI) assays. The swine pdm09s had variable antigenic reactivity to vaccine antisera, but each swine pdm09 clade exhibited significant reduction in cross-reactivity to one or more of the human seasonal vaccine strains. Further supporting zoonotic risk, we showed phylogenetic evidence for 17 swine-to-human transmission events of pdm09 from 2010 to 2021, 11 of which were not previously classified as variants, with each of the zoonotic cases associated with persistent circulation of pdm09 in pigs. These data demonstrate that reverse-zoonoses and evolution of pdm09 in swine results in viruses that are capable of zoonotic transmission and represent a potential pandemic threat.

60 APPLIED LIFE SCIENCES↗

DOE OSTI2023

Polymer Macrocycles: A novel topology to control dynamics of rubbery materials (Final Report)

We have successfully made synthetic polymer rings that are larger than previously reported having entanglement numbers as high as Z w ≈300 if the rings entangled as do linear chains. The synthesis was carried out using reversible radical recombination polymerization (R3P) of dithiols which produces a polymer with a very small persistence length. The reported results show surprising dilute solution behaviors due to the fact that polymeric rings expand more than their linear counterparts for polymer chains having a large number of persistence lengths, as developed in this study. The results strongly argue for a systematic investigation of the dilute solution properties of rings having different persistence lengths in different quality solvents, where the theta-condition should lead to results that are independent of the persistence length. For the rheological investigations related to chain entanglements, the polyDODT rings could be diluted so that the rheological data covered from less than one entanglement spacing relative to the linear counterpart to a value of Z w =300. Importantly, because we were able to dilute extremely high entanglement number polyDODT rings to a similar entanglement number as those reported for polystyrene rings that were highly purified using LCCC, we demonstrated that the dynamics of the polyDODT rings virtually overlaps with the dynamics of the polystyrene rings which is very strong evidence that these high molecular weight polyDODT rings are of high purity. Our results demonstrate that the onset of entanglement in rings, as evidenced by the appearance of a rubbery plateau G N 0 and by the onset of a strong power-law dependence of the viscosity on molecular weight (η~M w 5.8 ) or entanglement number (η~Z w 5.8 ), occurs at much higher molecular weights or polymer concentrations than is the case for linear chains. These results should serve as a benchmark for future investigations of the behavior of entangled, circular macromolecules.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2023

Polymer Macrocycles: A novel topology to control dynamics of rubbery materials

We have successfully made synthetic polymer rings that are larger than previously reported having entanglement numbers as high as $Z_w$≈300 if the rings entangled as do linear chains. The synthesis was carried out using reversible radical recombination polymerization (R3P) of dithiols which produces a polymer with a very small persistence length. The reported results show surprising dilute solution behaviors due to the fact that polymeric rings expand more than their linear counterparts for polymer chains having a large number of persistence lengths, as developed in this study. The results strongly argue for a systematic investigation of the dilute solution properties of rings having different persistence lengths in different quality solvents, where the theta-condition should lead to results that are independent of the persistence length. For the rheological investigations related to chain entanglements, the polyDODT rings could be diluted so that the rheological data covered from less than one entanglement spacing relative to the linear counterpart to a value of $Z_w$=300. Importantly, because we were able to dilute extremely high entanglement number polyDODT rings to a similar entanglement number as those reported for polystyrene rings that were highly purified using LCCC, we demonstrated that the dynamics of the polyDODT rings virtually overlaps with the dynamics of the polystyrene rings which is very strong evidence that these high molecular weight polyDODT rings are of high purity. Our results demonstrate that the onset of entanglement in rings, as evidenced by the appearance of a rubbery plateau $G_N^0$ and by the onset of a strong power-law dependence of the viscosity on molecular weight (η~$M_w^{5.8}$) or entanglement number (η~$Z_w^{5.8}$), occurs at much higher molecular weights or polymer concentrations than is the case for linear chains. These results should serve as a benchmark for future investigations of the behavior of entangled, circular macromolecules.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2025

Initial Uncertainty Analysis of Carbon Tetrachloride Contamination and Remediation in the Ringold A and Lower Mud Units at the Central Plateau

The long-term effectiveness of groundwater cleanup at the Hanford Site Central Plateau depends on predictive models that can capture key uncertainties in contaminant fate and transport. Carbon tetrachloride (CCl 4 ), a persistent and toxic compound, presents particular challenges due to variability in degradation rates, uncertainty in initial plume distribution, and subsurface heterogeneity. These uncertainties directly influence plume persistence, migration pathways, and remedy performance, and thus must be systematically evaluated to support long-term remediation planning. To address these gaps, a large-scale Monte Carlo analysis was conducted using the Plateau to River (P2R) model framework. The modeling approach parameterized three primary uncertainty factors: (1) degradation rate, (2) initial plume distribution, and (3) hydraulic conductivity. Degradation was represented as a first-order process, with half-lives ranging from 70 to 700 years. Initial plume distributions were created using a geostatistical simulation method (sgsim), which generates many equally plausible versions of how contaminants might be distributed underground. From this, 100 different scenarios were mapped onto the P2R grid. Variability in hydraulic conductivity was represented in a similar way, with 100 scenarios each for the Ringold Lower Mud and Ringold A units (layers 6 and 7), based on fitted exponential variograms and conditioned to well data. In total, more than 1000 realizations were simulated to assess plume behavior under uncertainty. Results demonstrate that degradation kinetics exert the strongest control over plume persistence: Shorter half-lives produced rapid mass reduction, while longer half-lives yielded persistent plumes with limited attenuation. A nonlinear response was observed, with steep mass reductions at half-lives greater than 200 years and near-linear declines beyond this threshold, reflecting interactions between degradation and pumping. The initial plume distribution strongly influenced early transport patterns, with broader sources generating larger plume footprints, although pump-and-treat operations constrained plume migration to managed areas. By comparison, hydraulic conductivity variability in the Ringold units had only a secondary influence, modifying spreading behavior without altering the dominant migration pathways governed by source configuration and hydraulic controls. Overall, the analysis highlights that uncertainty in degradation rate and initial plume configuration are the primary drivers of variability in plume predictions, while conductivity heterogeneity plays a limited role. These findings underscore the need for improved site-specific data on degradation processes and source characterization to enhance the reliability of long-term performance assessments and to better inform remedial decision-making at the Central Plateau.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗