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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 91 records · Page 5
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Nuclear Materials Packaging, Transportation, and Systems Analysis Group Software Quality Assurance Plan: ANSYS Mechanical Finite Element Analysis Software Version 2023R1

ANSYS Inc. develops and markets engineering simulation software and services used in the aerospace, automotive, manufacturing, electronics, biomedical, energy, defense, and many other industries. ANSYS is dedicated to engineering simulation and is the world’s leading software provider. ANSYS was founded in 1970 and is headquartered in Canonsburg, Pennsylvania. ANSYS provides an engineering analysis tool combining structural, thermal, computational fluid dynamics, acoustic, and electromagnetic simulation capabilities. ANSYS has two main programs, which use the same solvers: (1) Mechanical APDL (ANSYS Design Parametric Language), a Fortran-based coding platform, and (2) ANSYS Workbench, which uses a graphical user interface to aid in finite element analysis implementation. This plan covers both APDL and Workbench. The ANSYS computer program is a large-scale, multipurpose finite element program that can be used to solve several classes of engineering analyses. The analysis capabilities of ANSYS include the ability to solve static and dynamic structural analyses, steady-state and transient heat transfer problems, mode-frequency and buckling eigenvalue problems, static or time-varying magnetic analyses, and various types of field and coupled-field applications. The program contains many special features that allow nonlinearities or secondary effects such as plasticity, large strain, hyperelasticity, creep, swelling, large deflections, contact, stress stiffening, temperature dependency, material anisotropy, and radiation to be included in the solution. As ANSYS has been developed, other special capabilities such as substructuring, submodeling, random vibration, kinetostatics, kinetodynamics, free convection fluid analysis, acoustics, magnetics, piezoelectrics, coupled-field analysis, and design optimization have been added to the program. These capabilities contribute further to making ANSYS a multipurpose analysis tool for varied engineering disciplines. The ANSYS program has been in commercial use for over 50 years and has been used extensively in the aerospace, automotive, construction, electronic, energy services, manufacturing, nuclear, plastics, oil, and steel industries. Additionally, many consulting firms and hundreds of universities have used ANSYS for analysis, research, and educational purposes. ANSYS is recognized worldwide as one of the most widely used and capable programs of its type. Ansys design analysis software is the first created within a quality system with ISO 9001 certification, the internationally accepted quality standard. Product development, testing, maintenance and support processes also meet the United States Nuclear Regulatory Commission's quality requirements, as they have for nearly four decades. The Quality Assurance Service Agreement is suitable for the customers working in the nuclear industry who need to meet specific federal regulations including 10CRF50 Appendix B and provisions of 10CFR21. ANSYS has retained its original International Organization for Standardization (ISO) 9001 accreditation certificate since1995-05-04, It’s current certificate is valid until 2027-05-29.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2020

Two-Phase Fluid Flow Properties of Rough Fractures With Heterogeneous Wettability: Analysis With Lattice Boltzmann Simulations

Fractures are conduits for fluid flow in low-permeability geological formations. Multiphase flow properties of fractures are important in natural processes and in engineering applications such as the evaluation of the sealing capacity of caprocks and productivity of hydrocarbon-bearing tight rocks. Investigations of flow and transport through fractures typically focus on the effects of fracture geometric and mechanical factors such as aperture, roughness, and compressibility. The wettability of the fracture surfaces and its influence on microscale interfacial phenomena and macroscale effective transport properties are seldom studied. In this study, we investigated the effect of heterogeneous wetting properties on the displacement of water by supercritical CO2 through a series of lattice Boltzmann method simulations. The results show the evolution of the CO2 plume within a fracture is controlled by both the roughness of the aperture field and the wetting distribution. We combined these factors into a capillary pressure map that can be related to the macroscopic flow behavior of the fracture. We observed that heterogeneous wetting distributions promote the residual trapping of water where lower capillary pressures allowed for isolated water pockets in higher capillary pressure zones. Analysis of fracture unsteady relative permeability shows the effect of wetting on permeability evolution and provides support for the viscous-coupling relative permeability model. Finally, analysis of the steady-state relative permeability and saturation demonstrates a strong correlation between permeability and the standard deviation of the capillary pressure field. Thus, characterizing the distribution of wetting properties of fractures is crucial to understanding multiphase fracture flow and transport properties.

58 GEOSCIENCES↗
DOE OSTI2020

Molecular Structure of Sphingomyelin in Fluid Phase Bilayers Determined by the Joint Analysis of Small-Angle Neutron and X-ray Scattering Data

In this work, we have determined the fluid bilayer structure of palmitoyl sphingomyelin (PSM) and stearoyl sphingomyelin (SSM) by simultaneously analyzing small-angle neutron and X-ray scattering data. Using a newly developed scattering density profile (SDP) model for sphingomyelin lipids, we report structural parameters including the area per lipid, total bilayer thickness, and hydrocarbon thickness, in addition to lipid volumes determined by densitometry. Unconstrained all-atom simulations of PSM bilayers at 55 °C using the C36 CHARMM force field produced a lipid area of 56 Å 2 , a value that is 10% lower than the one determined experimentally by SDP analysis (61.9 Å2). Furthermore, scattering form factors calculated from the unconstrained simulations were in poor agreement with experimental form factors, even though segmental order parameter (S CD ) profiles calculated from the simulations were in relatively good agreement with S CD profiles obtained from NMR experiments. Conversely, constrained area simulations at 61.9 Å 2 resulted in good agreement between the simulation and experimental scattering form factors, but not with S CD profiles from NMR. We discuss possible reasons for the discrepancies between these two types of data that are frequently used as validation metrics for molecular dynamics force fields.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Scoreboard

Emerging HPC machines have given rise to enhanced compute power that far outstrips the machine's ability to save large scale results for post-processing. To combat this, in situ data analysis techniques are slowly being adopted. With in situ data management favoring workflows composed of multiple simulations and analyses connected in transit on heterogeneous machines, scientists and engineers need a tool that enables them to create data extracts, visualizations, and interactively monitor and steer their simulations. Scoreboard Phase II is a next generation analysis software that supports composite in transit workflows on heterogeneous architectures and restores interactivity to in situ data analysis through simulation monitoring and computational steering. Scoreboard provides a simulation dashboard with graphs of metrics over time, controls for setting custom simulation steering parameters, controls for managing the set of data extracts being produced in the simulation, as well as the ability to explore data extracts, all from a web browser. Realizing the vision outlined in this project required research into making a system that integrates end to end from simulations all the way to the user. In situ tools generally suffer from complexity and excessive software dependencies. Scoreboard, by contrast, is easy to build and integrate into simulation codes and it provides first class FORTRAN support. The Scoreboard library is capable of in situ and in transit data analysis that can produce data extracts commonly needed for Computational Fluid Dynamics (CFD) analysis. Simulations can transparently stage data in transit to a Scoreboard Endpoint program, which can accept their data and produce the requested data extracts. This lets simulations return to their work while the Endpoint works on the analysis. Efficiently staging the data at scale was a topic of this research. Scoreboard provides the means to let the user manage data extracts and monitor/steer many simulations from a web browser. This area of the research focused on discovery of in transit network components to expose and control their steering parameters within an interactive browser-based user interface that includes: system topology, gathered metrics, notifications, dynamically-generated steering controls, and exploration of visualization data products.

Whitlock, BradJoseph [Intelligent Light] (00000001↗
DOE OSTI2021

CFD Analysis of RLUOB Zone 1 HEPA Filter Plenum and Testing Manifolds

The purpose of this computational fluid dynamics (CFD) analysis is to ensure that Camfil Farr’s upstream and downstream injection and sampling manifolds can meet or exceed the requirements outlined in the ASME AG-1 1997 a(2000) Code on Nuclear Air and Gas Treatment for the testing of HEPA and adsorbent filters. This paper will present a numerical simulation of airflow in the Radiological Laboratory Utility Office Building (RLUOB) zone 1 HEPA filter plenum and testing manifolds using the commercial CFD software ANSYS FLUENT 2020R1. The CFD analysis focuses on the investigation of the air flow distribution and air-aerosol mixing uniformity. The evaluation was done for all steps of the modeling process: grid generation, physics setup, simulation, and post-processing. The mass flow rate in each section of the zone 1 injection and sampling manifolds is also reported.

42 ENGINEERING↗
DOE OSTI2023

Vibro-impact analysis and characterization of pipeline conveying fluids with multi-segmented motion-limiting constraints

Previous studies of the cantilevered pipeline conveying fluid system have included motion-limiting constraints in the form of trilinear springs. While this is desirable in experimental scenarios, it may not be representative of real-world applications. Therefore, here, this study focuses on multi-segmented motion-limiting constraints. As this type of motion-limiting constraint has not been investigated with a cantilevered pipeline system, a wide variety of outer and inner constraint stiffness and constraint gap sizes are investigated in this study to gain a comprehensive understanding of how the multi-segmented constraints affect the dynamics of the cantilevered pipeline. In this effort, bifurcation diagrams, phase portraits, Poincare maps, time histories, and power spectra are used to investigate the dynamics of the system, and the fluid flow speeds where dynamic characteristics are considered. In general, it is found that critical flow speeds like when the pipe sticks in the constraints are reduced as the constraint stiffnesses are increased. Additionally, the sticking flow speed occurred at lower flow speeds as the gap sizes of the inner and outer constraints decrease, and a larger constraint offset results in a smaller inner gap size leading to critical behaviors occurring at earlier flow speeds.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2020

Geochemical Changes in Response to CO 2 Injection in a CO 2 -EOR Complex in Northern Michigan

The overall purpose of the geochemical monitoring program under Midwestern Regional Carbon Sequestration Partnership (MRCSP) is to use stable and radiogenic isotope geochemistry in concert with analysis of general geochemical parameters of fluids and gases and analysis of core samples to determine geochemical processes occurring in the reef structure because of CO 2 injection..

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2020

Geochemical Changes in Response to CO 2 Injection in a CO 2 -EOR Complex in Northern Michigan (Volume II.1)

The Midwest Regional Carbon Sequestration Partnership (MRCSP) was founded in 2003 as part of the U.S. Department of Energy’s (DOE’s) Regional Carbon Sequestration Partnership initiative. Since its founding, MRCSP has made significant strides toward making CCUS a viable option for states in the region. The public/private consortium, funded through the DOE Regional Carbon Sequestration Initiative, brings together nearly 40 industry partners and 10 states. Battelle, as the project lead, oversees research, development and operations and coordinates activities among the partners. The incremental, phased approach has built a valuable knowledge base for the industry and paved the way for commercial-scale adoption of CCUS technologies. From 2008 to 2020, MRCSP Phase III focused on the development of large-scale injection projects. This report is part of a series of reports prepared under the Midwestern Regional Carbon Sequestration Partnership (MRCSP) Phase III (Development Phase). These reports summarize and detail the findings of the work conducted under the Phase III project. The report describes the geochemical monitoring program under MRCSP to use stable and radiogenic isotope geochemistry in concert with analysis of general geochemical parameters of fluids and gases and analysis of core samples to determine geochemical processes occurring in the reef structure because of CO 2 injection. Specifically, brine and gas samples were collected and analyzed to determine changes occurring between reefs prior to and following CO 2 injection. The analytical results for general geochemical parameters were modeled with chemical equilibrium models to determine if the injection of CO 2 resulted in the mineral dissolution or precipitation. Finally, core samples were collected and analyzed to determine if there was evidence of dissolution features or mineral precipitation.

01 COAL, LIGNITE, AND PEAT↗
DOE OSTI2020

Correlating inter-particle forces and particle shape to shear-induced aggregation/fragmentation and rheology for dilute anisotropic particle suspensions: A complementary study via capillary rheometry and in-situ small and ultra-small angle X-ray scattering

Predicting the stability of suspensions composed of anisotropic particles is difficult due to the complexity and interplay of hydrodynamic and colloidal forces. For example, it is not well understood how non-spherical particle shapes affect suspension-rheological responses. This study presents evidence showing how the stacking of boehmite platelets dispersed in aqueous solution leads to moderate shear thinning, even at low boehmite mass fractions. Wide angle X-ray, small angle X-ray, and ultra-small angle X-ray scattering were used to simultaneously monitor changes to the size and fractal dimensions of boehmite aggregates from 6 – 10,000 Å as the sample was recirculated through an in situ capillary rheometer. The latter also provided simultaneous measurements of the viscosity of the suspensions. Computational fluid dynamics modeling of the apparatus was used to provide a more rigorous analysis of the fluid flow. In addition to shear-induced aggregation/fragmentation correlated to a complicated balance between hydrodynamic and colloidal forces, the results indicate that orientationally-dependent interactions, arising from non-spherical boehmite aggregate sub-units, may explain the relatively large experimental viscosity when the hydrodynamic force is small compared to colloidal forces. Ultimately, the results from this study can provide a foundation for future work investigating particle shape effects on colloidal and hydrodynamics forces.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

Solid-to-Fluid Radiative Heat Transfer Modeling for System Analysis Module

System Analysis Module (SAM) is a system-level thermal hydraulics code being developed at Argonne National Laboratory for advanced nuclear reactor analysis. In addition to a wide range of interests from the advanced reactor design community, SAM has also been adopted by the United States Nuclear Regulatory Commission's suite of codes purposed for advanced reactor licensing. Nevertheless, the code is still under active development and new capabilities are being added to address various modeling and simulation challenges for advanced reactor analysis. One such phenomenon important to the thermal behavior of some advanced reactor concepts is radiative heat transfer (radHT). Conditions, such as high temperatures and long optical paths, increase the radiative contributions from solids and coolants alike. This paper discusses the development of radHT modeling in SAM and describes the new capabilities provided for thermal analysis. Depending on the geometry and temperatures of the system at hand, as well as the coolant in question, thermal transfer due to thermal radiation will vary dramatically. Therefore, the ability to model variable radiative systems was maintained as a priority during development of SAM radHT modeling. This newly developed simulation feature provides a flexible solid-to-fluid radiative heat transfer framework necessary for SAM to perform accurate analysis for advanced reactor designs. Test cases are also presented and shown to match analytical solutions, which demonstrate the radHT model's efficacy.

Radiative heat transfer↗
DOE OSTI2022

Convective heat transfer and friction factor characteristics of molten salts in spirally fluted tubes

Spirally fluted tubes have been widely used for heat exchangers due to their superior heat transfer enhancement. However, most of the previous studies focused on the effects of a limited number of geometric parameters, i.e., the flute pitch and flute depth, on convective heat transfer and friction factor characteristics of low-Prandtl-number fluids, i.e., air and water. The correlations developed in these studies may not be accurate or applicable for medium-Prandtl-number fluids, such as molten salts. A numerical analysis using a Computational Fluid Dynamics (CFD) tool, STAR–CCM+, is therefore carried out in this study to systematically investigate the effects of four geometric parameters, including the flute pitch ρ, flute depth e, flute start number N s (or flute helix angle θ), and trough length L tr on convective heat transfer and friction factor characteristics of a medium-Prandtl-number fluid, FLiNaK (46.5LiF-11.5NaF-42KF mol %), in spirally fluted tubes. Additionally, the convective heat transfer and Darcy friction factor correlations are proposed and validated, with ± 20% uncertainties, for medium-Prandtl-number fluids under the following conditions: Re = 88–1600, Pr = 2.5–40, ρ/D c = 0.44–3.51, e/D c = 0.10–0.40, θ/90= 0.20–0.81, and L tr /D c = 0.71–2.16. The correlations proposed help improve the design of spirally fluted-tube heat exchangers.

42 ENGINEERING↗
DOE OSTI2023

ECAR-7210 Rev 0 Steady-state Thermo-mechanical Analysis of the MARVEL Fuel Bundle

This document reports the steady-state thermal-hydraulic and static mechanical analyses of the MARVEL micro-reactor core. The objective of this work is to investigate whether fuel-to-fuel contact could occur due to the thermal deformation of the fuel cladding during the normal operation and to assess the resulting impact on the peak cladding temperatures (PCT) if contact occurs. The scope of the work consists of three computational tasks. First, a conjugate heat transfer analysis using computational fluid dynamics (CFD) model was performed to evaluate the PCTs during normal operating conditions. Second, a finite element analysis (FEA) using the cladding temperature field obtained from the CFD analysis was performed to evaluate the thermal deformation of cladding and determine the occurrence of fuel-to-fuel contact. Finally, a CFD analysis of FEA-informed fuel-to-fuel gap (represented by a conservative 0.05 mm uniform gap) was performed to evaluate whether the PCT exceeds the safety criteria.

21 - SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLAN↗
DOE OSTI2020

Computational Analysis of Water Film Thickness During Rain Events for Assessing Hydroplaning Risk, Part 1: Nearly Smooth Road Surfaces

In the research work reported here, both two- and three-dimensional computational fluid dynamics (CFD) analysis was used to investigate modern road geometries that were not frequently encountered in the latter half of the 20th century but are much more common today. The relation of newer road geometries to the water film thickness that develops on travel lanes was a major focus of this work.

42 ENGINEERING↗
DOE OSTI2022

Modular system and method for mercury speciation in a fluid sample

Modular Hg analysis devices and methods are described for use in mercury speciation protocols. Modules can be selected and removably connected to one another to specifically target mercury species in a sample so as to accurately determine the presence or quantity of different mercury species in a fluid sample. Modules can include reductants for reducing inorganic mercury to form elemental mercury and amalgamation agents to capture the elemental mercury. Modules can include filters for capture of particulates as well as capture agents, e.g., solid phase extraction agents, for capture of organic mercury species.

Looney, Brian B.↗
DOE OSTI2023

Fluidic carbon nanotube device

Fluidic and electrofluidic devices comprising carbon nanotubes and methods of making and using the same are provided. The carbon nanotubes may be densely bundled to span an aperture in a substrate. A polymeric coating over the substrate may contain reservoir(s) etched therein, the reservoir(s) in fluid connectivity with the carbon nanotubes. X-rays may be directed through the aperture and fluid-filled carbon nanotubes with x-ray analysis providing data on fluid structure and dynamics inside the carbon nanotubes.

Meshot, Eric R.↗
DOE OSTI2026

Glovebox CFD Analysis: Low-Flow, Laminar CFD Analysis of Glovebox Ventilation and Humidity Transport in Ansys Fluent 2025 R1

There are gloveboxes that frequently exceed the 30% relative humidity level required for operations. These exceedances result in alternative operations needing to be utilized. This report documents a computational fluid dynamics (CFD) analysis performed to characterize airflow and humidity transport within a representative glovebox under nominal, low-flow conditions. The analysis focuses on establishing the flow regime, identifying transport-limited regions, and evaluating the implications of laminar flow on humidity removal. A single-phase, laminar flow model with a species transport model was used to represent air and water vapor mixing. Results demonstrate that, at the nominal flow rates, airflow is laminar with weak mixing, which will result in long residence times, tens of minutes long or more, in low-velocity regions. These conclusions suggests that humidity reduction is transport-limited. This analysis provides qualitative insight into airflow structure and humidity transport trends. In addition to characterization of glovebox airflow and humidity transport, results are intended to inform experimental validation and future transient modeling efforts.

42 ENGINEERING↗
DOE OSTI2020

Three-Dimensional CFD Analysis of Construction Design Alternatives for an ERDC Coastal and Hydraulics Laboratory Flow Accelerator

The U.S. Army Engineer Research and Development Center, ERDC, Coastal and Hydraulics Laboratory in Vicksburg Mississippi is planning to build a large flume with a 10-foot-wide flow channel. Three-dimensional Computational Fluid Dynamics (CFD) analysis was used in the design of the flume entry and flow accelerator sections that feed into the 10-foot-wide channel. The design is based on the plans of the existing fiberglass flume inlet at the Turner-Fairbank Highway Research Center (TFHRC) J. Sterling Jones Hydraulics Research Laboratory in McLean Virginia. The TFHRC flume inlet feeds water to a 6-foot-wide flume channel, and therefore a scale up factor of 10/6 in the width of the inlet section of the TFHRC flume would meet the width requirement of the ERDC flume channel. The CFD analysis was performed using STAR-CCM+ commercial CFD software. Additional analysis was done with the open-source CFD software, OpenFOAM, to cross-check the analysis of one of the cases with a code-to-code comparison.

42 ENGINEERING↗