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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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At least 1,135 records · Page 63
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

A mechanistic study on environment gas in laser powder bed fusion

A variety of protective or reactive environmental gases have recently gained growing attention in laser-based metal additive manufacturing (AM) technologies due to their unique thermophysical properties and the potential improvements they can bring to the build processes. However, much remains unclear regarding the effects of different gas environments on critical phenomena in laser AM, such as rapid cooling, energy coupling, and defect generation. Through simultaneous high-speed synchrotron x-ray imaging and thermal imaging, we identify distinct effects of two environmental gases in laser AM and gained a deeper understanding of the underlying mechanisms. Compared to the commonly used protective gas, argon, it is found that helium has a negligible effect on cooling the part. However, helium can suppress unstable keyholes by decreasing effective energy absorption, thus mitigating keyhole porosity generation and reducing pore size under certain processing conditions. In conclusion, these observations provide guidelines for the strategic use of environmental gases in laser AM to produce parts with improved quality.

36 MATERIALS SCIENCE↗
DOE OSTI2026

A time-parallel method for scalable heat transfer simulations of additive manufacturing

Here, a major challenge in simulating the thermal behavior in additive manufacturing processes is the disparate length and time scales between transport phenomena occurring in the melt pool and the component. A common simulation approach relies on spatial decomposition for parallel computing, but due to the nature of heat transfer in AM, where most of the computational expenditure is localized near the melt pool, the computational speedup from spatial parallelization saturates quickly. Therefore, additional parallelism by means of time-domain decomposition is needed to fully take advantage of high-performance computing (HPC) resources. This work introduces a time-parallel method to improve the computational scalability of additive manufacturing simulations on HPC systems, while maintaining high temporal resolution of heat transfer near the melt pool. The method, inspired by the nonlinear paraexp formalism, performs an iterative superposition of nonlinear solutions to the initial value problem, integrating the heat equation across overlapping time-parallel intervals. For a single layer of the NIST AMB2018–01 L7 benchmark problem, the method achieves a 38.51x speedup in wall-clock time with a maximum error in the global temperature solution of 0.99%. This reduces the total solution time from 196.72 min to 5.11 min on 128 nodes of the ORNL Frontier supercomputer. The tradeoff between accuracy and total wall-clock time is investigated and recommendations for time-parallel deployment for AM problems are made.

Additive manufacturing↗
DOE OSTI2024

The Method of Finite Averages: A rigorous upscaling methodology for heterogeneous porous media

Rigorous upscaling techniques offer accurate and computationally-efficient strategies for modeling the average behaviors of multi-physical, multiscale phenomena in geological porous media. However, such techniques often rely on a variety of methodological assumptions that prohibit their rigorous application to practical systems (e.g., systems involving heterogeneous porous media, system-scale boundary conditions, and fine-scale dynamics that are not diffusion-dominant). In this work, we aim to formulate an upscaling methodology with few methodological assumptions to provide high levels of model generality and foster the utilization of rigorously-derived upscaled models in practice. In particular, we introduce the Method of Finite Averages (MoFA), a novel upscaling methodology for rigorously modeling heterogeneous porous media and system-scale boundary conditions. We then detail MoFA’s implementation for the advective–diffusive transport of a single species and compare the methodology with classic numerical techniques, as well as other rigorous upscaling techniques, to highlight MoFA’s unique combination of rigor and generality. We then validate the derived model while demonstrating its benefits in three numerical experiments. The results suggest that (1.) the applicability and a priori error guarantees of MoFA models do not directly depend on system geometry, (2.) a model’s applicability and error guarantees can be can arbitrarily expanded and reduced, respectively, with further computational expense, and (3.) downscaling with MoFA provides an efficient strategy for generating accurate pore-scale solutions from upscaled results. Ultimately, the results evidence that upscaled models can be rigorously derived for heterogeneous porous media systems and resolved in a fraction of the time it takes to perform the equivalent pore-scale simulations.

58 GEOSCIENCES↗
DOE OSTI2021

A two-phase three-field modeling framework for heat pipe application in nuclear reactors

Heat pipes and two-phase thermosyphons are highly efficient heat transfer devices utilizing continuous evaporation and condensation of working fluid for two-phase heat transport in closed systems. Because of the nearly isothermal and fully passive phase-change heat transfer mechanism, heat pipes and thermosyphons have found many applications in nuclear engineering, space technologies, and other energy systems. High-temperature heat pipes are used in nuclear microreactors to remove fission power from the primary system and are coupled with power conversion systems or process heat applications. Modeling of the two-phase flow phenomena inside a heat pipe is essential to its design and safety analysis. In this study, a comprehensive one-dimensional two-phase three-field flow model has been developed for the analysis of heat pipes in normal operation conditions and transients. The conservation or field equations of mass, momentum, and energy were developed for the liquid film, vapor, and droplet. In addition, constitutive models or correlations were reviewed thoroughly and provided for the closure of the three-field equations. Specific constitutive equations regarding interfacial mass and heat transfer at two interfaces, namely film-gas interface and gas-droplet interface, were reviewed for droplet entrainment and deposition rates as well as film and droplet evaporation rates. Furthermore, mechanistic correlations of annular flow film thickness were recommended for the modeling of the thermosyphons without a wick as a critical constitutive correlation. Furthermore, experimental data needs from new experiments using a prototype working fluid or surrogate fluids for the model validation of high-temperature heat pipes in microreactors were recommended for future research.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2023

High-fidelity simulations of the run-in process for a pebble-bed reactor

Pebble-bed reactors (PBRs) rely on a continual feed of fuel pebbles being cycled through the core. As a result, they require a “run-in” period in order to reach an equilibrium state. The run-in period for a PBR is a complex, time-dependent problem that requires the injection of new fuel, different types of fuel, and power increases. This complexity in the run-in makes it important to capture the physical processes in order to generate an accurate representation. The present work details the creation of a high-fidelity Monte Carlo methodology for analyzing the run-in and subsequent approach to equilibrium for PBRs. The methodology entails a Python module wrapped around Serpent so as to perform neutronics calculations, move pebbles, refuel the core, and discharge pebbles, thereby modeling the explicit behavior of the PBR run-in. Further, three run-in simulations (a constant temperature profile, a linear temperature profile, and a constant temperature profile using control rods) were examined in order to identify the key physical phenomena present in the run-in process. Utilizing kugelpy, we found the inclusion of a temperature profile to be important for accurately capturing a discharge burnup (around 141 MWd/kg), a consistent k-eff (around 1.005), and an average pebble power (around 2.5 kW/pebble) that all fall within acceptable limits.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2024

Neutron transport methods for multiphysics heterogeneous reactor core simulation in Griffin

Griffin is a reactor physics application based on the Multiphysics Object-Oriented Simulation Environment (MOOSE). This work discloses the methods, algorithms, and implementation for simulating heterogeneous reactor dynamics models. Griffin utilizes a discontinuous finite-element method with discrete ordinates (DFEM-S ) to discretize the field variable of the multigroup neutron transport equation. Multiphysics feedback is handled using two-step tabulated cross-section methodology. Feedback quantities are evaluated using the MOOSE-MultiApp system to couple various engineering phenomena, such as heat conduction and thermal fluids. The multiphysics DFEM-S system is solved using fixed-point iteration with a fully asynchronous parallel sweeper, unstructured coarse-mesh finite difference acceleration, and a multi-timescale improved quasi-static method scheme. The implementation is applied to a multiphysics microreactor model, with two transients: one initiated by a single heat-pipe failure and another by control drum rotation. Importantly, these examples demonstrate the ability of Griffin to tractably solve the neutron transport equation considering seven independent variables and feedback.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2024

The AGN-201 Digital Twin: A test bed for remotely monitoring nuclear reactors

Research reactors have historically provided researchers and scientists with a means for testing and understanding the workings of nuclear phenomena. With the lack of new research reactors built in the past decades, it is important now more than ever to utilize and provide evidence for the usefulness of research reactors. Here, this work explores the use of the AGN-201 research reactor at Idaho State University as a test bed for developing a digital twin (named the AGN-201 DT) to realize remote monitoring for nuclear reactors. The goal of the AGN-201 DT is to monitor the AGN-201 reactor and detect when undeclared events take place to provide information for a monitoring agency. The AGN-201 DT was able to detect (without a priori knowledge) when multiple undeclared experiments were placed in the core using on-the-fly machine learning and reactor physics analysis. The AGN-201 reactor provided a test bed for developing, deploying, and testing a digital twin for monitoring nuclear reactors.

21 - SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLAN↗
DOE OSTI2025

Studies of the influence of heat pipe model and coupling strategy in heat pipe microreactor simulations using Sockeye

This work demonstrates various modeling approaches for thermally coupling heat pipes to a graphite monolithic block in a microreactor context, accounting for the presence of a gap. We show that heat pipe model selection has a significant impact on the transient behavior of a three-dimensional coupled microreactor assembly problem by comparing results obtained using different heat pipe models from the heat pipe code Sockeye. Additionally, we show that the choice of coupling strategy has significant consequences for both accuracy and performance. Furthermore, we found that our heat flux transfer strategy exhibited greater accuracy than our temperature transfer strategy, even when comparing a loose coupling of the heat flux transfer strategy to a tight coupling of the temperature transfer strategy. Although this research uses only theoretical test problems, it provides important insights in modeling thermal fluids phenomena in heat pipe microreactors.

Direwolf↗
DOE OSTI2019

Extended quasilocal Thermodynamics of Schwarzchild–anti de Sitter black holes

Highlights: •A Hamiltonian approach to the quasilocal SAdS Thermodynamics is introduced. •The cosmological constant is considered a function on phase space. •The quasilocal SAdS Thermodynamics is extended. •A new equation of state for the quasilocal SAdS Thermodynamics is constructed. •The role of homogeneity and stability in the SAdS Thermodynamics is studied. -- Abstract: In this work we study a homogeneous and quasilocal Thermodynamics associated to the Schwarzschild–anti de Sitter black hole. The usual thermodynamic description is extended within a Hamiltonian approach with the introduction of the cosmological constant in the thermodynamic phase space. The macroscopic treatment presented is consistent in as much as it respects the laws of black hole Thermodynamics and accepts the introduction of any thermodynamic potential. We are able to construct new equations of state that characterize the Thermodynamics. Novel phenomena can be expected from the proposed setup.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2021

The response field and the saddle points of quantum mechanical path integrals

Highlights: • Moyal quantum mechanics and Marinov’s path integral. • Classical and semiclassical limits of Marinov’s path integral. • Oscillating functional integrals. • Instantons of the Marinov’s path integral. In quantum statistical mechanics, Moyal’s equation governs the time evolution of Wigner functions and of more general Weyl symbols that represent the density matrix of arbitrary mixed states. A formal solution to Moyal’s equation is given by Marinov’s path integral. In this paper we demonstrate that this path integral can be regarded as the natural link between several conceptual, geometric, and dynamical issues in quantum mechanics. A unifying perspective is achieved by highlighting the pivotal role which the response field, one of the integration variables in Marinov’s integral, plays for pure states even. The discussion focuses on how the integral’s semiclassical approximation relates to its strictly classical limit; unlike for Feynman type path integrals, the latter is well defined in the Marinov case. The topics covered include a random force representation of Marinov’s integral based upon the concept of “Airy averaging”, a related discussion of positivity-violating Wigner functions describing tunneling processes, and the role of the response field in maintaining quantum coherence and enabling interference phenomena. The double slit experiment for electrons and the Bohm–Aharonov effect are analyzed as illustrative examples. Furthermore, a surprising relationship between the instantons of the Marinov path integral over an analytically continued (“Wick rotated”) response field, and the complex instantons of Feynman-type integrals is found. The latter play a prominent role in recent work towards a Picard–Lefschetz theory applicable to oscillatory path integrals and the resurgence program.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2021

Physics of the Inverted Harmonic Oscillator: From the lowest Landau level to event horizons

In this work, we present the inverted harmonic oscillator (IHO) Hamiltonian as a paradigm to understand the quantum mechanics of scattering and time-decay in a diverse set of physical systems. As one of the generators of area preserving transformations, the IHO Hamiltonian can be studied as a dilatation generator, squeeze generator, a Lorentz boost generator, or a scattering potential. In establishing these different forms, we demonstrate the physics of the IHO that underlies phenomena as disparate as the Hawking–Unruh effect and scattering in the lowest Landau level (LLL) in quantum Hall systems. We derive the emergence of the IHO Hamiltonian in the LLL in a gauge invariant way and show its exact parallels with the Rindler Hamiltonian that describes quantum mechanics near event horizons. This approach of studying distinct physical systems with symmetries described by isomorphic Lie algebras through the emergent IHO Hamiltonian enables us to reinterpret geometric response in the lowest Landau level in terms of relativistic effects such as Wigner rotation. Further, the analytic scattering matrix of the IHO points to the existence of quasinormal modes (QNMs) in the spectrum, which have quantized time-decay rates. We present a way to access these QNMs through wave packet scattering, thus proposing a novel effect in quantum Hall point contact geometries that parallels those found in black holes.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2021

Quantum kinetics of anomalous and nonlinear Hall effects in topological semimetals

Highlights: • Linear and photogalvanic anomalous Hall responses are systematically derived. • Extrinsic mechanisms of AHE include Gaussian, diffractive, hybrid skew scattering. • Diagrammatic calculations are matched to semiclassical picture of AHE. • The Pancharatnam phase of multifold fermions determines the skew scattering amplitude. • Photon-induced interband scattering are accompanied by coordinate shifts. We present a systematic microscopic derivation of the semiclassical Boltzmann equation for band structures with the finite Berry curvature based on Keldysh technique of nonequilibrium systems. In the analysis, an AC electrical driving field is kept up to quadratic order, and both cases of small and large frequencies corresponding to intra- and interband transitions are considered. In particular, this formulation is suitable for the study of nonlinear Hall effect and photogalvanic phenomena. The role of impurity scattering is carefully addressed. Specifically, in addition to previously studied side-jump and skew-scattering processes, quantum interference diffractive contributions are now explicitly incorporated within the developed framework. This theory is applied to multifold fermions in topological semimetals, for which the generic formula for the skew scattering rate from the Pancharatnam phase is obtained along with the corresponding anomalous Hall conductivity.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Coherent multiple scattering of out-of-equilibrium interacting Bose gases

We review recent theoretical and experimental progresses in the coherent multiple scattering of weakly interacting disordered Bose gases. These systems have allowed, in the recent years, a characterization of weak and strong localization phenomena in disorder at an unprecedented level of control. In this paper, we first discuss the main physical concepts and recent experimental achievements associated with a few emblematic “mesoscopic” effects in disorder like coherent backscattering, coherent forward scattering or mesoscopic echos, focusing on the context of out-of-equilibrium cold-atom setups. We then address the role of weak particle interactions and explain how, depending on their relative strength with respect to the disorder and on the time scales probed, they can give rise to a dephasing mechanism for weak localization, thermalize a non-equilibrium Bose gas or make it become a superfluid.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2021

Some aspects of the five-dimensional Lovelock black hole spacetime: Strong homotopy retract, perihelion precession and quasistationary levels

Highlights: • Some topological aspects are explored. • The perihelion precession is calculated. • The general Heun functions are applied to obtain analytical solutions. • The quasibound states and the radial wave eigenfunctions are obtained. In this work we explore some mathematical physics aspects of the spherically symmetric Lovelock black hole in high dimensions. Intended for this aim, we thoroughly consider the metric corresponding to the five-dimensional Lovelock black hole spacetime. We construct the strong retractions by the geodesic equations on the background under consideration. As a result, from the topological point of view, we construct the theory of strong homotopy retract, which will allow us, in principle, to better understand some of its suitable applications on astrophysics and cosmology, in particular, in the analysis of the spacetime singularities. We find the solutions of the equation of motion for both radial and angular coordinates, and then we describe the outer (“exterior”) and lower (“interior”) apparent horizons. Indeed, the outer apparent horizon is the last surface from which the light waves could still escape from the black hole. Thus, it is meaningful to analyze some physical phenomena related to quantum particles propagating outside the exterior apparent horizon, in particular, we discuss the quasistationary levels of scalar fields and their radial wave functions, which are given in terms of the general Heun functions. We also calculate the perihelion precession in this background.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2022

Equation of state of neutron-rich matter in d -dimensions

Nuclear systems under constraints, with high degrees of symmetries and/or collectivities may be considered as moving effectively in spaces with reduced spatial dimensions. We first derive analytical expressions for the nucleon specific energy E 0 (ρ), pressure P 0 (ρ), incompressibility coefficient K 0 (ρ) and skewness coefficient J 0 (ρ) of symmetric nucleonic matter (SNM), the quadratic symmetry energy E sym (ρ), its slope parameter L(ρ) and curvature coefficient K sym (ρ) as well as the fourth-order symmetry energy E sym,4 (ρ) of neutron-rich matter in general d spatial dimensions (abbreviated as "dD") in terms of the isoscalar and isovector parts of the isospin-dependent single-nucleon potential according to the generalized Hugenholtz-Van Hove (HVH) theorem. The equation of state (EOS) of nuclear matter in dD can be linked to that in the conventional 3-dimensional (3D) space by the ε-expansion which is a perturbative approach successfully used previously in treating second-order phase transitions and related critical phenomena and more recently in studying the EOS of cold atoms. The ε-expansion of nuclear EOS in dD based on a reference dimension d f = d – ε is shown to be effective with –1 ≲ ε ≲ 1 starting from 1 ≲ d f ≲ 3 in comparison with the exact expressions derived using the HVH theorem. Moreover, the EOS of SNM (with/without considering its potential part) is found to be reduced (enhanced) in lower (higher) dimensions, indicating in particular that the many-nucleon system tends to be deeper bounded but saturate at higher densities in spaces with lower dimensions. Here, the links between the EOSs in 3D and dD spaces from the ε-expansion provide new perspectives to the EOS of neutron-rich matter.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2025

Genuine k -partite correlations and entanglement in the ground state of the Dicke model for interacting qubits

Here, in this work, we calculate and study correlations of the Dicke model in the presence of qubit–qubit interaction. Whereas the analysis of correlations among its subsystems is essential for the understanding of corresponding critical phenomena and for performing quantum information tasks, the majority of correlation measures are restricted to bipartitions due to the inherent challenges associated with handling multiple partitions. To circunvent this we employ the calculation of Genuine Multipartite Correlations (GMC) based on the invariance of our model under particle permutation. We then quantify the correlations within each subpart of the system, as well as the percentage contribution of each GMC of order $k$, highlighting the many-body behaviors for different regimes of parameters. Additionally, we show that GMC signal both first- and second-order quantum phase transitions present in the model. Furthermore, as GMC encompasses both classical and quantum correlations, we employ Quantum Fisher Information (QFI) to detect genuine multipartite entanglement. Ultimately, we map the Dicke model with interacting qubits to spin in solids interacting with a quantum field of magnons, thus demonstrating a potential experimental realization of this model.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2020

Leveraging inter-firm influence in the diffusion of energy efficiency technologies: An agent-based model

Energy efficiency technologies (EETs) are crucial for saving energy and reducing carbon dioxide emissions. However, the diffusion of EETs in small and medium-sized enterprises is rather slow. Literature shows the interactions between innovation adopters and potential adopters have significant impacts on innovation diffusion. Enterprises lack the motivation to share information, and EETs usually lack observability, which suppress the inter-firm influence. Thus, an information platform, together with proper policies encouraging or forcing enterprises to disclose EET-related information, should help harness inter-firm influence to accelerate EETs' diffusion. To explore whether and how such an information platform affects EETs' diffusion in small and medium-sized enterprises, this report builds an agent-based model to mimic EET diffusion processes. Based on a series of controlled numerical experiments, some counter-intuitive phenomena are discovered and explained. The results show that the information platform is a double-edged sword that notably accelerates EETs' diffusion by approximately 47% but may also boost negative information to diffuse even faster and delay massive adoption of EETs. Increasing network density and the intensity of inter-firm influence are effective to speed EET diffusion, but their impacts diminish drastically after reaching some critical values (0.05 and 0.15 respectively) and eventually harm the stability of the system. Ultimately, the findings implicate that EET suppliers should carefully launch their promising but immature products; policies that can reduce the perceived risk by enterprises and the effort to maintain an informative rather than judgmental information platform can prominently mitigate the negative side effects brought by high fluidity of information.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2021

Thermochemical reduction modeling in a high-temperature moving-bed reactor for energy storage: 1D model

The design of robust and efficient high-temperature thermochemical reactors and determination of operating conditions are critical steps toward enabling high-efficiency long-duration solar energy storage. This work presents a computational model for the thermal reduction of a metal oxide material (Mg-Mn-O) up to 1450 °C and the coupled complex transport phenomena in a novel tubular thermal reactor design that features the capability for a high extent-of-reduction (high energy storage density) and inherent heat recuperation. A one-dimensional model coupling counter-current gas–solid flow, two-phase heat transfer, thermochemical redox reactions, and species transport in a moving-bed reactor is developed. Simplified versions of the model are validated with published results in the literature for packed beds with both inert and reactive particles; the fully coupled model is also validated with experimental measurements of a moving-bed reactor in terms of local temperatures and oxygen release at the exit. Detailed comparisons on the effects of different boundary conditions in the reaction zone (prescribed wall temperature vs. heat flux conditions) and formulations based on a simple uniform flow assumption vs. plug flow using Ergun equation for gas flow are investigated. The results are compared with experimental measurements, and for all cases, the energy flow components in the reactor system and the thermal to chemical conversion efficiency and overall system efficiency are computed. Finally, the predicted high thermal-to-chemical efficiency ~95% and system efficiency ~30% agree with experimental measurements.

25 ENERGY STORAGE↗