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Technical Paper

Development and Validation of a Reduced Chemical Kinetic Mechanism of Dimethyl Carbonate and Ethylene Carbonate

2024-04-09
2024-01-2085
With the rapid development of electric vehicles, the demands for lithium-ion batteries and advanced battery technologies are growing. Today, lithium-ion batteries mainly use liquid electrolytes, containing organic compounds such as dimethyl carbonate and ethylene carbonate as solvents for the lithium salts. However, when thermal runaway occurs, the electrolyte decomposes, venting combustible gases that could readily be ignited when mixed with air and leading to pronounced heat release from the combustion of the mixture. So far, the chemical behavior of electrolytes during thermal runaway in lithium-ion batteries is not comprehensively understood. Well-validated compact chemical kinetic mechanisms of the electrolyte components are required to describe this process in CFD simulations. In this work, submechanisms of dimethyl carbonate and ethylene carbonate were developed and adopted in the Ansys Model Fuel Library (MFL).
Technical Paper

Capturing Combustion Chemistry of Carbon-Neutral Transportation Fuels with a Library of Model Fuels

2023-09-29
2023-32-0001
Carbon-neutral (CN) fuels will be part of the solution to reducing global warming effects of the transportation sector, along with electrification. CN fuels such as hydrogen, ammonia, biofuels, and e-fuels can play a primary role in some segments (aviation, shipping, heavy-duty road vehicles) and a secondary role in others (light-duty road vehicles). The composition and properties of these fuels vary substantially from existing fossil fuels. Fuel effects on performance and emissions are complex, especially when these fuels are blended with fossil fuels. Predictively modeling the combustion of these fuels in engine and combustor CFD simulations requires accurate representation of the fuel blends. We discuss a methodology for matching the targeted fuel properties of specific CN fuels, using a blend of surrogate fuel components, to form a fuel model that can accurately capture fuel effects in an engine simulation.
Technical Paper

IMPACT: Numerical Study of Aerodynamics of an Iced Forward-Swept Tail with Leading Edge Extension

2023-06-15
2023-01-1371
In-flight icing significantly influences the design of large passenger aircraft. Relevant aspects include sizing of the main aerodynamic surfaces, provision of anti-icing systems, and setting of operational restrictions. Empennages of large passenger aircraft are particularly affected due to the small leading edge radius, and the requirement to generate considerable lift for round out and flare, following an extended period of descent often in icing conditions. This paper describes a CFD-based investigation of the effects of sweep on the aerodynamic performance of a novel forward-swept horizontal stabilizer concept in icing conditions. The concept features an unconventional forward sweep, combined with a high lift leading edge extension (LEX) located within a fuselage induced droplet shadow zone, providing passive protection from icing.
Technical Paper

A Three-Layer Model for Ice Crystal Icing in Aircraft Engines

2023-06-15
2023-01-1481
This paper presents the current state of a three-layer surface icing model for ice crystal icing risk assessment in aircraft engines, being developed jointly by Ansys and Honeywell to account for possible heat transfer from inside an engine into the flow path where ice accretion occurs. The bottom layer of the proposed model represents a thin metal sheet as a substrate surface to conductively transfer heat from an engine-internal reservoir to the ice layer. The middle layer is accretion ice with a porous structure able to hold a certain amount of liquid water. A shallow water film layer on the top receives impinged ice crystals. A mass and energy balance calculation for the film determines ice accretion rate. Water wicking and recovery is introduced to transfer liquid water between film layer and porous ice accretion layer.
Technical Paper

Numerical Study of Iced Swept-Wing Performance Degradation using RANS

2023-06-15
2023-01-1402
This paper studies the level of confidence and applicability of CFD simulations using steady-state Reynolds-Averaged Navier-Stokes (RANS) in predicting aerodynamic performance losses on swept-wings due to contamination with ice accreted in-flight. The wing geometry selected for the study is the 65%-scale Common Research Model (CRM65) main wing, for which NASA Glenn Research Center’s Icing Research Tunnel has generated experimental ice shapes for the inboard, mid-span, and outboard sections. The reproductions at various levels of fidelity from detailed 3D scans of these ice shapes have been used in recent aerodynamic testing at the Office National d’Etudes et Recherches Aérospatiales (ONERA) and Wichita State University (WSU) wind tunnels. The ONERA tests were at higher Reynolds number range in the order of 10 million, while the WSU tests were in the order of 1 million.
Journal Article

Thermal Reduced Order Modeling for System Analysis of EV Battery

2023-04-11
2023-01-0931
The safety, performance, and operational life of power dense Lithium-ion batteries used in Hybrid and Electric Vehicles are dependent on the operating temperature. Modeling and simulation are essential tools used to accelerate the design process of optimal thermal management systems. However, high-fidelity 3D computational fluid dynamics (CFD) simulation of such systems is often difficult and computationally expensive. In this paper, we demonstrate a multi-part coupled system model for simulating the heating/cooling system of the traction battery at a module level. We have reduced computational time by employing reduced-order modeling (ROM) framework on separate 3D CFD models of the battery module and the cooling plate. The order of the thermal ROM has also been varied to study the trade-off between accuracy, fidelity, and complexity. The ROMs are bidirectionally coupled to an empirical battery model built from in-house test data.
Technical Paper

Predicting the Combustion Behavior in a Small-Bore Diesel Engine

2021-04-06
2021-01-0508
Accurate modeling of the characteristics of diesel-engine combustion leads to more efficient design. Accurate modeling in turn depends on correctly capturing spray dynamics, turbulence, and fuel chemistry. This work presents a computational fluid dynamics (CFD) investigation of a well characterized small-bore direct injection diesel engine at Sandia National Laboratories’ Combustion Research Facility. The engine has been studied for two piston-bowls geometries and various injection timings. Simulation of these conditions test the predictive capabilities of our approach to diesel engine modeling using Ansys Forte. An experimental database covering a wide range of operating conditions is provided by the Engine Combustion Network for this engine, which is used to validate our modeling approach. Automatic and solution-adaptive meshing is used, and the recommended settings are discussed.
Technical Paper

Validation Studies of a Detailed Soot Chemistry for Gasoline and Diesel Engines

2021-04-06
2021-01-0618
Accurately predicting the evolution of soot mass and soot particle numbers under engine conditions is critical to advanced engine design. A detailed soot-chemistry model that can capture soot under gasoline and diesel conditions without tuning is necessary for such predictions. Building confidence in the predictive usage of the chemistry in engine simulations requires validating the soot kinetics over a wide range of operating conditions and fuels, using data from different experimental techniques, and using sources from laboratory flames to engines. This validation study focuses on a soot-chemistry model that considers multiple nucleation, growth, and oxidation reaction pathways. It involves 14 gas-phase precursors and considers the effect of different soot-particle surface sites.
Technical Paper

Multi-Objective Aerodynamic Optimization of Vehicle Shape Using Adjoint Approach Based on Steady-State and Transient Flow Solutions

2021-04-06
2021-01-0945
In order to achieve the purpose of saving energy and reducing emission, the improvement of aerodynamic performance plays an increasingly crucial role for car manufacturers. Previous studies have confirmed the validity of gradient-based adjoint algorithm for its high efficiency in shape optimization. In this paper, two important aspects of adjoint approach were explored. One is vehicle aerodynamic optimization with multiple objectives, and the other is using time-averaged flow results as the primal solution, both are issues of high interest in recent applications. First, adjoint shape optimization with steady-state and time-averaged flow simulations were respectively calculated and comparatively discussed based on a production SUV. The shape modifications of the two cases indicated that the impact of primal solution on design change could not be neglected, due to the different intrinsic codes of steady and transient turbulence models.
Technical Paper

Multi-Shot Icing Simulations with Automatic Re-Meshing

2019-06-10
2019-01-1956
A full-automated CFD mesh generation technique has been developed and implemented for 3-D aircraft icing simulations to permit robust 45-minute ice accretion simulations in support of icing certification campaigns. The changes in the shape of the aircraft surfaces due to accreting ice and their effects on the air and droplet flow are accounted for in a quasi-steady manner by subdividing the total icing time into sequential steps of shorter duration, updating the computational grid at each step. This “multi-shot” ice accretion approach requires robust and accurate grid re-meshing for it to be embedded in engineering design and analysis workflows. ANSYS FENSAP-ICE has been coupled to Fluent Meshing to take advantage of generic and highly automated surface displacement and mesh wrapping tools. A wide spectrum of geometries is supported, ranging from full-size aircraft to air data probes, turbomachinery components, rotors and propellers.
Technical Paper

Numerical Simulation of Aircraft and Variable-Pitch Propeller Icing with Explicit Coupling

2019-06-10
2019-01-1954
A 3D CFD methodology is presented to simulate ice build-up on propeller blades exposed to known icing conditions in flight, with automatic blade pitch variation at constant RPM to maintain the desired thrust. One blade of a six-blade propeller and a 70-passenger twin-engine turboprop are analyzed as stand-alone components in a multi-shot quasi-steady icing simulation. The thrust that must be generated by the propellers is obtained from the drag computed on the aircraft. The flight conditions are typical for a 70-passenger twin-engine turboprop in a holding pattern in Appendix C icing conditions: 190 kts at an altitude of 6,000 ft. The rotation rate remains constant at 850 rpm, a typical operating condition for this flight envelope.
Technical Paper

Numerical Modelling of Primary and Secondary Effects of SLD Impingement

2019-06-10
2019-01-2002
A CFD simulation methodology for the inclusion of the post-impact trajectories of splashing/bouncing Supercooled Large Droplets (SLDs) and film detachment is introduced and validated. Several scenarios are tested to demonstrate how different parameters affect the simulations. Including re-injecting droplet flows due to splashing/bouncing and film detachment has a significant effect on the accuracy of the validations shown in the article. Validation results demonstrate very good agreement with the experimental data. This approach is then applied to a full-scale twin-engine turboprop to compute water impingement on the wings and the empennage.
Technical Paper

An Ice Shedding Model for Rotating Components

2019-06-10
2019-01-2003
A CFD simulation methodology is presented to evaluate the ice that sheds from rotating components. The shedding detection is handled by coupling the ice accretion and stress analysis solvers to periodically check for the propagation of crack fronts and possible detachment. A novel approach for crack propagation is highlighted where no change in mesh topology is required. The entire computation from flow to impingement, ice accretion and crack analysis only requires a single mesh. The accretion and stress module are validated individually with published data. The analysis is extended to demonstrate potential shedding scenarios on three complex industrially-relevant 3D cases: a helicopter blade, an engine fan blade and a turboprop propeller. The largest shed fragment will be analyzed in the context of FOD damage to neighboring aircraft/component surfaces.
Technical Paper

An Eulerian Approach with Mesh Adaptation for Highly Accurate 3D Droplet Dynamics Simulations

2019-06-10
2019-01-2012
Two main approaches are available when studying droplet dynamics for in-flight icing simulations: the Lagrangian approach, in which each droplet trajectory is integrated until it impacts the vehicle under study or when it leaves it behind without impact, and the Eulerian approach, where the droplet dynamics is solved as a continuum. In both cases, the same momentum equations are solved. Each approach has its advantages. In 2D, the Lagrangian approach is easy to code and it is very efficient, particularly when used in combination with a panel method flow solver. However, it is a far less practical approach for 3D simulations, particularly on complex geometries, as it is not an easy task to accurately determine the droplet seeding region without a great number of droplet trajectories, dramatically increasing the computing cost. Converting the impact locations into a water collection distribution is also a complex task, since droplet trajectories in 3D can follow convoluted paths.
Technical Paper

Numerical Simulation of Ice Crystal Accretion Inside an Engine Core Stator

2019-06-10
2019-01-2017
A CFD simulation methodology is presented to calculate blockage due to ice crystal icing of the IGV passages of a gas turbine engine. The computational domain consists of six components and includes the nacelle, the full bypass and the air induction section up to the second stage of the low-pressure compressor. The model is of a geared turbofan with a fan that rotates at 4,100 rpm and a low-pressure stage that rotates at 8,000 rpm. The flight conditions are based on a cruising speed of Mach 0.67 in Appendix-D icing conditions with an ice crystal content is 4.24 g/m3. Crystal bouncing, and re-entrainment is considered in the calculations, along with variable relative humidity and crystal melting due to warmer temperatures within the engine core. Total time of icing is set to 20 seconds. The CFD airflow and ice crystal simulations are performed on the full 6-stage domain. The initial icing calculation determines which stage will be chosen for a more comprehensive analysis.
Technical Paper

Numerical Demonstration of the Humidity Effect in Engine Icing

2019-06-10
2019-01-2015
The importance of the variation of relative humidity across turbomachinery engine components for in-flight icing is shown by numerical analysis. A species transport equation for vapor has been added to the existing CFD methodology for the simulation of ice growth and water flow on engine components that are subject to ice crystal icing. This entire system couples several partial differential equations that consider heat and mass transfer between droplets, crystals and air, adding the cooling of the air due to particle evaporation to the icing simulation, increasing the accuracy of the evaporative heat fluxes on wetted walls. Three validation cases are presented for the new methodology: the first one compares with the numerical results of droplets traveling inside an icing tunnel with an existing evaporation model proposed by the National Research Council of Canada (NRC).
Technical Paper

Impact of Aromatics on Engine Performance

2019-04-02
2019-01-0948
Aromatics constitute a significant portion of refinery fuels. Characterizing the impact of various aromatic components on combustion and emissions facilitates formulation of surrogate fuels for engine simulations. The impact of blending aromatics in fuel surrogates is usually nonlinear for ignition characteristics responsible for knocking in spark engines and for combustion phasing in diesel engines. In this work, we have characterized the behavior of nine aromatics components under engine-relevant conditions. A self-consistent and validated detailed kinetics mechanism has been developed for gasoline and diesel surrogates that contains toluene, ethylbenzene, n-propylbenzene, n-butylbenzene, isomers of xylene, 1,2,4-trimethylbenzene, and 1-methylnaphthalene. Numerical experiments using 0-D and 1-D models have been performed to study the relative behavior of these aromatics for different reacting conditions.
Technical Paper

The Computational Cost and Accuracy of Spray Droplet Collision Models

2019-04-02
2019-01-0279
This study focuses on Lagrangian spray models that are commonly used in engine CFD simulations. In modeling sprays, droplet collision is one of the physical phenomena that must be accounted for. There are two main parts of droplet collision models for sprays - detecting colliding pairs of droplets and predicting the outcomes of these collisions. For the first part, we focus on the efficiency of the algorithm. We present an implementation of the arbitrary adaptive collision mesh model of Hou and Schmidt [1], and examine its efficiency in dealing with large simulations. Through theoretical analysis and numerical tests, we show that the computational cost of this model scales pseudo-linearly with respect to the number of parcels in the sprays. Regarding the second part, we examine the variations in existing phenomenological models used for predicting binary droplet collision outcomes. A quantitative accuracy metric is used to evaluate the models with respect to the experimental data set.
Technical Paper

Alternate Approach: Acoustics and Cooling Performance Management

2018-04-03
2018-01-0084
Development of quick and efficient numerical tools is key to the design of industrial machines. While Computational Fluid Dynamics (CFD) techniques based on Navier Stokes (N-S) and Lattice Boltzman methods are becoming popular, predicting aeroacoustic behavior for complex geometries remains computationally intensive for design process and iteration. The goal of this paper is to evaluate application Navier-Stokes approach coupled with Ffowcs Williams and Hawkings (FW-H), and Broad-band Noise Model (BNS) to evaluate noise levels and predict design direction for industrial applications. Steady-state RANS based approaches are used to evaluate under-hood cooling performance and fan power demand. At each design iteration, noise levels and strength of noise source are evaluated using Gutin’s and broad-band noise models, respectively along with cooling performance. Each design feature selected for the final design has lower fan power and noise level with improved cooling.
Journal Article

A Linear Parameter Varying Combined with Divide-and-Conquer Approach to Thermal System Modeling of Battery Modules

2016-05-01
2015-01-9148
A linear parameter varying (LPV) reduced order model (ROM) is used to approximate the volume-averaged temperature of battery cells in one of the modules of the battery pack with varying mass flow rate of cooling fluid using uniform heat source as inputs. The ROM runs orders of magnitude faster than the original CFD model. To reduce the time it takes to generate training data, used in building LPV ROM, a divide-and-conquer approach is introduced. This is done by dividing the battery module into a series of mid-cell and end-cell units. A mid-cell unit is composed of a cooling channel sandwiched in between two half -cells. A half-cell has half as much heat capacity as a full-cell. An end-cell unit is composed of a cooling channel sandwiched in between full-cell and a half-cell. A mass flow rate distribution look-up-table is generated from a set of steady-state simulations obtained by running the full CFD model at different inlet manifold mass flow rate samples.
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