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DOE OSTI2022

An experimental study on round-trip efficiency of a preheating control with a medium office building

The interactions between building energy efficiency and demand response (DR) with buildings may complicate their impacts on the electricity grid and buildings, yet those interactions are not well understood. This work fills this gap by presenting an experimental study that quantifies the effects of DR on building energy efficiency. Unlike existing studies, this work 1) investigates the uncertainty levels when assessing the effects of DR; 2) studies the impact of rooftop heat pumps with direct expansion refrigerant-to-air coils on the round-trip efficiency. Specifically, we considered a medium office building (~1860 m 2 ), which is served by rooftop units, located in eastern Washington State. We performed preheating control tests during typical heating days in the year 2022 and compared the building’s energy consumption during the testing days to that during normal operation days under similar weather conditions. To understand how well those normal operation days represent the baseline for the assessment, the relationship between the energy performance of this building and weather conditions was also studied. Experimental results reveal that the round-trip efficiency (i.e., the ratio of discharging energy output from the building to charging energy input into the building) was between 0.16 and 0.92. The results show that significant energy loss may occur during the preheating process. Finally, it also suggests a significant correlation between the energy efficiency of the studied building under the preheating control and the outdoor temperature; and a highly nonlinear relationship between the zone temperature changing rate and the weather condition.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2022

Slope parameter of the symmetry energy and the structure of three-particle interactions in nuclear matter

In the first part of this paper, we present a study of the symmetry energy (a s ) and its slope parameter (L) for nuclear matter in the framework of the Fermi liquid theory of Landau and Migdal. We derive an exact relation between a s and L, which involves the nucleon effective masses and three-particle Landau-Migdal parameters. We present simple estimates which suggest that there are two main mechanisms to explain the empirical values of L: The proton-neutron effective mass difference in isospin asymmetric matter and the ℓ = 0 moment of the isovector in-medium three-particle scattering amplitude. In the second part of this paper, we discuss the general structure of three-particle interactions in nuclear matter in the framework of the Fermi liquid theory. The connections to the Bethe-Brueckner-Goldstone theory and other approaches are also discussed. Finally, we show explicitly how the first few terms in the Faddeev series, together with medium induced three-particle interactions, emerge naturally in the Fermi liquid theory.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2021

Emulating the impact of additional proton-proton interactions in the ATLAS simulation by pre-sampling sets of inelastic Monte Carlo events

The accurate simulation of additional interactions at the ATLAS experiment for the analysis of proton-proton collisions delivered by the Large Hadron Collider presents a significant challenge to the computing resources. During the LHC Run (2015-2018) there were up to 70 inelastic interactions per bunch crossing, which need to be accounted for in Monte Carlo (MC) production. In this document, a new method to account for these additional interactions in the simulation chain is described. Instead of sampling the inelastic interactions and adding their energy deposits to a hard-scatter interaction one-by-one, the inelastic interactions are presampled, independent of the hard scatter, and stored as combined events. Consequently, for each hard-scatter interaction only one such presampled event needs to be added as part of the simulation chain. For the Run 2 simulation chain, with an average of 35 interactions per bunch crossing, this new method provides a substantial reduction in MC production CPU needs of around 20%, while reproducing the properties of the reconstructed quantities relevant for physics analyses with good accuracy.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2026

NGEE Arctic Integrated Modeling (IM3): Improved snow-vegetation interaction

This data product represents the integration of new code capability for arctic tundra snow-vegetation-terrain interactions into the Energy Exascale Earth System Model (E3SM), through the E3SM Land Model (ELM) component. This code integration is the result of collaborative effort between the NGEE Arctic project and the E3SM project. The NGEE Arctic project developed a total of six Integrated Modeling (IM) modules informed by observations and experiments. New ELM capability represented by this data product (IM3) falls into three categories: 1) Downscaling from gridcell to topographic unit level when working through the existing coupler bypass code. 2) Four new parameters (taper, stocking, bendresist, and vegshape) have been added to ELM to allow for flexible definition of snow-vegetation interactions. 3) Vegshape and bendresist parameters are used to calculate the fraction of leaf area and/or stem area buried by snow for a given snow depth. This data record consists of a single document (pdf format) that describes the theoretical basis for the snow-vegetation-terrain interactions added to ELM, and describes the modifications made to the ELM code. The Methods section of this metadata record includes a link to the public E3SM code repository where the exact code modifications as integrated in E3SM can be accessed. The Next-Generation Ecosystem Experiments: Arctic (NGEE Arctic), was a research effort to reduce uncertainty in Earth System Models by developing a predictive understanding of carbon-rich Arctic ecosystems and feedbacks to climate. NGEE Arctic was supported by the Department of Energy's Office of Biological and Environmental Research. The NGEE Arctic project had two field research sites: 1) located within the Arctic polygonal tundra coastal region on the Barrow Environmental Observatory (BEO) and the North Slope near Utqiagvik (Barrow), Alaska and 2) multiple areas on the discontinuous permafrost region of the Seward Peninsula north of Nome, Alaska. Through observations, experiments, and synthesis with existing datasets, NGEE Arctic provided an enhanced knowledge base for multi-scale modeling and contributed to improved process representation at global pan-Arctic scales within the Department of Energy's Earth system Model (the Energy Exascale Earth System Model, or E3SM), and specifically within the E3SM Land Model component (ELM).

Thornton, Peter E [ORNL] (ORCID:0000000247595158)↗

DOE OSTI2026

Regression Convolutional Neural Network for Energy Estimation in NOvA

Regression Convolutional Neural Network for Energy Estimation in NOvA" Abstract: "NOvA (NuMI Off-Axis $\nu_e$ Appearance) is a long baseline neutrino experiment designed to measure neutrino oscillations over a distance of 810 km. NOvA employs a near and far detector to observe $\nu_\mu$ disappearance and $\nu_e$ appearance of neutrinos produced by the NuMI beam at Fermilab. Energy reconstruction is critical for precise measurements of neutrino oscillation parameters and cross sections, which are functions of neutrino energy. Energy estimation remains difficult due to the complexity of detector response and final state particle kinematics. We present a regression-based convolutional neural network (CNN) method that reconstructs neutrino and lepton energies based on raw pixel inputs for NOvA. The trained model is able to reconstruct event energy for different interaction modes and complex final states containing leptons and hadrons. Studies of regression CNN networks show improved energy resolution and reduced sensitivity to calibration scale uncertainties relative to traditional kinematics-based energy reconstruction techniques. The results demonstrate the potential of the regression CNN method for neutrino physics analyses by improving on standard kinematics-based reconstruction.

Zhao, Larry [UC, Irvine (main)]↗

DOE OSTI2022

GCAM-USA v5.3_water_dispatch: integrated modeling of subnational US energy, water, and land systems within a global framework

Abstract. This paper describes GCAM-USA v5.3_water_dispatch, an open-source model that represents key interactions across economic, energy, water, and land systems in a consistent global framework with subnational detail in the United States. GCAM-USA divides the world into 31 geopolitical regions outside the United States (US) and represents the US economy and energy systems in 51 state-level regions (50 states plus the District of Columbia). The model also includes 235 water basins and 384 land use regions, and 23 of each fall at least partially within the United States. GCAM-USA offers a level of process and temporal resolution rare for models of its class and scope, including detailed subnational representation of US water demands and supplies and sub-annual operations (day and night for each month) in the US electric power sector. GCAM-USA can be used to explore how changes in socioeconomic drivers, technological progress, or policy impact demands for (and production of) energy, water, and crops at a subnational level in the United States while maintaining consistency with broader national and international conditions. This paper describes GCAM-USA's structure, inputs, and outputs, with emphasis on new model features. Four illustrative scenarios encompassing varying socioeconomic and energy system futures are used to explore subnational changes in energy, water, and land use outcomes. We conclude with information about how public users can access the model.

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2025

Autonomous sensor suite for evaluating fish-turbine interactions and environmental impacts in marine renewable energy and hydropower

Marine renewable energy (MRE) harnesses ocean-based resources such as waves, tides, currents, and thermal or salinity gradients for sustainable power generation. It has the potential to complement existing renewable resources, support remote communities, and contribute to decarbonization efforts. However, understanding the hydrodynamic forces created by MRE devices and their impacts on marine life is critical for responsible deployment. Here, to address these concerns, advanced sensor devices, including the Marine Sensor Fish (MSF), Sensor Fish Mini (SF Mini), and Flexible Sensor Fish (FSF), were developed to measure interactions between aquatic organisms and MRE systems. This paper details the design, manufacturing, calibration, and field deployment of these sensor suites, highlighting their ability to capture key physical stressors such as shear forces, pressure changes, and collision impacts. The MSF successfully evaluated turbine interactions at a tidal turbine in the Salish Sea, capturing data on turbulence, collision impact, and pressure gradients. The SF Mini validated hydrodynamic conditions in scaled hydraulic models, supporting computational fluid dynamics simulations. The FSF, with its flexible silicone body, measured species-specific impacts in turbulent environments. This research demonstrates the potential of Sensor Fish technology to advance sustainable marine energy systems by reducing biological impacts and informing environmentally sustainable designs.

Ecological impacts↗

DOE OSTI2025

Reconstruction of beam parameters and betatron radiation spectra measured with a Compton spectrometer

The photon flux resulting from high-energy electron beam interactions with high-field systems, such as those found in the upcoming FACET-II experiments at the SLAC National Accelerator Laboratory, yields deep insight into the electron beam’s underlying dynamics during the interaction. However, extracting this information is an intricate process. To demonstrate how to approach this challenge using modern methods, this paper utilizes simulated data that models plasma wakefield acceleration-derived betatron radiation in experiments to determine reliable methods of reconstructing key beam and beam-plasma interaction properties. For betatron radiation measurements, translating the observed 200⁢ keV to 30⁢ MeV photon double-differential energy-angle spectra obtained from an advanced Compton spectrometer requires testing multiple methods to optimize the pipeline from its response to incident electron beam information. The paper compares maximum likelihood estimation and machine learning to refine the translation of photon spectra into precise electron beam metrics, such as spot size, energy, and emittance, enhancing the understanding of beam behavior within these dense, high-field environments. We also introduce machine learning and the expected maximization algorithm to reconstruct the primary photon spectrum, employing a multilayer neural network for regression analysis of the energy and angle spectra. With appropriate modifications, the advanced methods reproduce relevant incident beam parameters with high accuracy, even for beam sizes in the <10 μ⁢m range. This capacity is critical to understanding intense beam propagation and its optimization in plasma.

Beam code development & simulation techniques↗

DOE OSTI2025

Neutrino Physics and Astrophysics at Colliders

Nonzero neutrino masses guarantee new physics and neutrinos are excellent probes of extreme environments in the Universe. The recent collider neutrino experimental program, including FASER$ν$ and SND@LHC, along with the planned Forward Physics Facility at the High-Luminosity Large Hadron Collider, is opening a new window into neutrino physics and astrophysics. In this article, we review recent achievements and prospects of collider neutrino experiments, including key achievements such as the first measurements of collider neutrino interactions at unprecedented energies and the exploration of new physics scenarios, like dark matter candidates, sterile neutrinos, and non-standard neutrino interactions. For concreteness, we will focus on the significant scientific opportunities presented by the Forward Physics Facility, which will enable precision measurements of neutrino cross sections and proton structure at low parton momentum fraction. Furthermore, collider neutrino studies will substantially reduce systematic uncertainties in calculating atmospheric neutrino fluxes, thereby improving astrophysical neutrino observations as well as advancing our understanding of cosmic-ray interactions.

Machado, Pedro [Fermilab] (ORCID:0000000291187354)↗

DOE OSTI2023

Total neutron cross-section measurement on CH with a novel 3D-projection scintillator detector

In order to extract neutrino oscillation parameters, long-baseline neutrino oscillation experiments rely on detailed models of neutrino interactions with nuclei. These models constitute an important source of systematic uncertainty, partially because detectors to date have been blind to final state neutrons. Three-dimensional projection scintillator trackers comprise components of the near detectors of the next generation long-baseline neutrino experiments. Due to the good timing resolution and fine granularity, this technology is capable of measuring neutron kinetic energy in neutrino interactions on an event-by-event basis and will provide valuable data for refining neutrino interaction models and ways to reconstruct neutrino energy. Two prototypes have been exposed to the neutron beamline at Los Alamos National Laboratory (LANL) in both 2019 and 2020, with neutron energies between 0 and 800 MeV. In order to demonstrate the capability of neutron detection, the total neutron-scintillator cross section as a function of neutron energy is measured and compared to external measurements. The measured total neutron cross section in scintillator between 98 and 688 MeV is 0.36 ± 0.05 barn.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2021

Moving from scientific research to consenting guidance for MRE environmental risk

Potential environmental effects from tidal and wave devices are of concern to regulators, advisors, and other stakeholders in many nations. Monitoring results from early deployments and the first commercial arrays, coupled with targeted research studies, are providing a growing base of knowledge of how components of tidal turbines and wave energy converters might interact with marine animals and habitats. Efforts are underway to organize and direct these findings towards facilitating consenting that allays concerns and allows the marine renewable energy (MRE) industry to move forward. The OES-Environmental international initiative has developed scientific evidence bases for several key interactions from MRE devices, organized around stressors (portions of MRE systems that may cause injury or stress to the marine ecosystem), and receptors (the animals, habitats, and ecosystem processes that may be affected). This paper summarizes the evidence bases for four stressors (underwater noise, electromagnetic fields, habitat change, and changes in oceanographic systems) and presents the process of moving from the scientific knowledge into guidance documents to support the regulatory process. The guidance documents will serve as a broad guide that can be used internationally to look at stressor-receptor interactions of interest within a regulatory context. The evidence bases and guidance documents aim to assist MRE developers, regulators, and advisors with project scoping, consenting, and licensing processes.

Copping, Andrea E.↗

DOE OSTI2021

Quantum Monte Carlo studies of a trimer scaling function with microscopic two- and three-body interactions

Here, we present an energy scaling function to predict, in a specific range, the energy of bosonic trimers with large scattering lengths and finite range interactions, which is validated by quantum Monte Carlo calculations using microscopic Hamiltonians with two- and three-body potentials. The proposed scaling function depends on the scattering length, effective range, and a reference energy, which we chose as the trimer energy at unitarity. We obtained the scaling function as a limit cycle from the solution of the renormalized zero-range model with effective range corrections. We proposed a simple parametrization of the energy scaling function. Besides the intrinsic interest in theoretical and experimental investigations, this scaling function allows one to probe Efimov physics with only the trimer ground states, which may open opportunities to identify Efimov trimers whenever access to excited states is limited.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2024

New physics at a neutron beam dump

We find a new utility of neutrons, usually treated as an experimental nuisance causing unwanted background, in probing new physics signals. The new physics signals can either be radiated from neutrons (neutron bremsstrahlung) or appear through secondary particles from neutron-on-target interactions, dubbed “neutron beam dump.” As a concrete example, we take the FASER/FASER2 experiment as a “factory” of high-energy neutrons that interact with the iron dump. We find that if new physics particles had the same interaction strength to protons and neutrons, their production rate via neutron-initiated bremsstrahlung would be comparable to that via proton-initiated ones, in terms of the resulting flux and the range of couplings that can be probed. The neutron bremsstrahlung can be used, for instance, to probe dark gauge bosons with nonzero neutron coupling. In particular, we investigate protophobic gauge bosons and find that FASER/FASER2 can probe new parameter space. We also illustrate the possibility of neutron-induced secondary particles by considering axionlike particles with electron couplings. We conclude that the physics potential of FASER/FASER2 in terms of new physics searches can be greatly extended and improved with the inclusion of neutron interactions. Published by the American Physical Society 2024

Astronomy & Astrophysics↗

DOE OSTI2023

Spatial Environmental Assessment Tool (SEAT)

SAND2024-08551O The Spatial Environmental Assessment Tool (SEAT) evaluates potential environmental risk associated with marine energy device deployment by coupling modeled impacts with risk severity maps. As a graphical user interface-based software, it interacts with marine energy stressor and receptor data to evaluate the risk of changes to marine environment. SEAT, which relies on spatial and temporal data, is a plug-in for geospatial software QGIS. Sandia National Laboratories is a multimission laboratory managed and operated by National Technology & Engineering Solutions of Sandia, LLC, a wholly owned subsidiary of Honeywell International Inc., for the U.S. Department of Energy’s National Nuclear Security Administration under contract DE-NA0003525.

Chartrand, Chris↗

DOE OSTI2022

[Fe 4 S 4 ] cubane in sulfite reductases: new insights into bonding properties and reactivity

The dissimilatory sulfite reductase enzyme has very characteristic active site where the substrate binds to an iron site, ligated by a siroheme macrocycle and a thiol directly connected to a [Fe 4 S 4 ] cluster. This arrangement gives the enzyme remarkable efficiency in reducing sulfite and nitrite all the way to hydrogen sulfide and ammonia. For the first time we present a theoretical study where substrate binding modalities and activation are elucidated using active site models containing proton supply side chains and the [Fe 4 S 4 ] cluster. Density functional theory (DFT) was deployed in conjunction with the energy decomposition scheme (as implemented in AMS), the quantum theory of atoms in molecules (QTAIM), and conceptual DFT (cDFT) descriptors. We quantified the role of the electrostatic interactions inside the active site created by the side chains as well as the influence of the [Fe4S4] cluster on the substrate binding. Furthermore, using conceptual DFT results we shed light of the activation process, thus, laying foundation for further mechanistic studies. We found that the bonding of the ligands to the iron complex is dominated by electrostatic interactions, but the presence of the [Fe 4 S 4 ] cubane leads to substantial changes in electronic interaction. The spin state of the cubane, however, affects the binding energy only marginally. The conceptual DFT results show that the presence of the [Fe 4 S 4 ] cubane affects the reactivity of the active site as it is involved in electron transfer. This is corroborated by an increase in the electrophilicity index, thus making the active site more prone to react with the ligands. The interaction energies between the ligand and the siroheme group are also increased upon the presence of the cubane group, thus, suggesting that the siroheme group is not an innocent spectator but plays an active role in the reactivity of the dSIR active site.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2025

Evolution of Magnetohydrodynamic Turbulence in the Expanding Solar Wind: Residual Energy and Intermittency

We conduct 3D magnetohydrodynamic simulations of decaying turbulence in the context of the solar wind. To account for the spherical expansion of the solar wind, we implement the expanding box model. The initial turbulence comprises uncorrelated counterpropagating Alfvén waves and exhibits an isotropic power spectrum. Our findings reveal the consistent generation of negative residual energy whenever nonlinear interactions are present, independent of the normalized cross helicity σc and compressibility. The spherical expansion facilitates this process. The resulting residual energy is primarily distributed in the perpendicular direction, with S 2 (b) − S 2 (u) ∝ l ⊥ or equivalently –E r ∝ k$^{–2}_{⟂}$. Here S 2 (b) and S 2 (u) are second-order structure functions of magnetic field and velocity respectively. In most runs, S 2 (b) develops a scaling relation S 2 (b) ∝ $l$$^{1/2}_{⊥}$ (E b ∝ k$^{–3/2}_{⟂}$). In contrast, S 2 (u) is consistently shallower than S 2 (b), which aligns with in situ observations of the solar wind. We observe that the higher-order statistics of the turbulence, which act as a proxy for intermittency, depend on the initial σc and are strongly affected by the expansion effect. Generally, the intermittency is more pronounced when the expansion effect is present. Finally, we find that in our simulations, although the negative residual energy and intermittency grow simultaneously as the turbulence evolves, the causal relation between them seems to be weak, possibly because they are generated on different scales.

Interplanetary turbulence↗

DOE OSTI2021

Renewable energy and biological conservation in a changing world

Without a shift to renewable energy sources, climate change will have adverse effects on many terrestrial and aquatic species. On the other hand, replacing fossil fuels with renewable energy will have different effects on wildlife, some negative. To protect biota, while navigating the complexities surrounding the transition to renewable energy, will require sharing knowledge between energy experts and wildlife experts, as well as policy makers and resource managers. This special issue is intended to advance the conversation. Interactions between renewable energy facilities and fauna are complex. Each source of renewable energy has its own conservation concerns, and each presents its own set of opportunities for mitigation; Other concerns and mitigations are shared. In this overview, we review climate risks to biota, clarify the complementarities among renewables for the conservation community, and summarize research on energy effects on biota for the energy community. The papers invited for this special issue address fossil (coal, oil, natural gas) and renewable energy (terrestrial biomass energy, hydropower, marine-hydrokinetic energy, wind energy, solar energy) and affected fauna. Finally, we hope that the results of these studies, and others like them, set us on a path toward low-carbon energy systems that provide society with energy while protecting future biodiversity.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

DOE OSTI2019

Typical occupancy profiles and behaviors in residential buildings in the United States

The energy performance of a residential building is highly dependent on occupant's presence or non-presence in a building and their interactions with energy-consuming appliances. Typical occupancy schedules for residential buildings must be defined for applications such as building energy modeling as well as for assessing energy savings associated with the use of occupancy sensing technologies and occupancy-dependent controls. Currently, commonly used simulation programs assume a typical occupancy schedule, however, there is significant opportunity for improvement to these schedules as this is generally based on engineering judgement. This research uses 12 years of the American Time Use Survey (ATUS) data to develop typical occupancy schedules for a range of household types and occupant age ranges. This is compared to currently utilized residential occupancy schedules. In many cases the developed schedules exhibit similar patterns, however, differences are also found to be as high as 41% for certain periods of time. For occupancy sensing applications, the spatial-temporal distribution of occupants in residential buildings is also evaluated. These locations vary based on temporal factors as well as demographic factors such as age and number of occupants. Finally, the results of this research work towards improved occupancy schedule development can benefit both industry professionals and researchers.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗