Canada
Shock Initiated Ignition for Hydrogen Mixtures of Different Concentrations
Sep 2011
Publication
The scenario of ignition of fuels by the passage of shock waves is relevant from the perspective of safety primarily because shock ignition potentially plays an important role in deflagration to detonation transition. Even in one dimension simulation of ignition between a contact surface or a flame and a shock moving into combustible mixture is difficult because of the singular nature of the initial conditions. Indeed initially as the shock starts moving away from the contact surface the region filled with shocked reactive mixture does not exist. In the current work the formulation is transformed using time and length over time as the independent variables. This transformation yields a finite domain from t = 0. In this paper the complete spatial and temporal ignition evolution of hydrogen combustible mixtures of different concentrations is studied numerically. Integration of the governing equations is performed using an Essentially Non-Oscillatory (ENO) algorithm in space and Runge-Kutta in time while the chemistry is modeled by a three-step chain-branching mechanism which appropriately mimics hydrogen combustion.
Hydrogen Fueling Standardization: Enabling ZEVs with "Same as Today" Fueling and FCEV Range and Safety
Oct 2015
Publication
Zero Emission Vehicles (ZEVs) are necessary to help reduce the emissions in the transportation sector which is responsible for 40% of overall greenhouse gas emissions. There are two types of ZEVs Battery Electric Vehicles (BEVs) and Fuel Cell Electric Vehicles (FCEVs) Commercial Success of BEVs has been challenging thus far also due to limited range and very long charging duration. FCEVs using H2 infrastructure with SAE J2601 and J2799 standards can be consistently fuelled in a safe manner fast and resulting in a range similar to conventional vehicles. Specifically fuelling with SAE J2601 with the SAE J2799 enables FCEVs to fill with hydrogen in 3-5 minutes and to achieve a high State of Charge (SOC) resulting in 300+ mile range without exceeding the safety storage limits. Standardized H2 therefore gives an advantage to the customer over electric charging. SAE created this H2 fuelling protocol based on modelling laboratory and field tests. These SAE standards enable the first generation of commercial FCEVs and H2 stations to achieve a customer acceptable fueling similar to today's experience. This report details the advantages of hydrogen and the validation of H2 fuelling for the SAE standards.
Validation Testing In Support Of Hydrogen Codes and Standards Developments
Sep 2011
Publication
New codes and standards are being developed to facilitate the safe deployment of emerging hydrogen technologies. Hydrogen markets will benefit from standards that address the specific properties of hydrogen hydrogen effects on strength of materials and hydrogen compressed gas storage at pressures up to 70 MPa. The need for validation of new hydrogen requirements has been identified by codes and standards technical committees. The US Department of Energy (DOE) office of Energy Efficiency and Renewable Energy (EERE) has tasked the National Renewable Energy Laboratory (NREL) with the role of supporting hydrogen codes and standards research and development needs. NREL has provided validation test support to several new standards development efforts including pressure testing of 70 MPa on board vehicle storage systems flaw testing of stationary hydrogen tanks fill protocols for hydrogen fuel dispensing and hydrogen compatibility testing for hydrogen pressure relief devices (HPRD’s). Validation test results are presented for these four specific standards development needs.
Measurements of Flow Velocity and Scalar Concentration in Turbulent Multi-component Jets
Sep 2017
Publication
Buoyancy effects and nozzle geometry can have a significant impact on turbulent jet dispersion. This work was motivated by applications involving hydrogen. Using helium as an experimental proxy buoyant horizontal jets issuing from a round orifice on the side wall of a circular tube were analyzed experimentally using particle image velocimetry (PIV) and planar laser-induced fluorescence (PLIF) techniques simultaneously to provide instantaneous and time-averaged flow fields of velocity and concentration. Effects of buoyancy and asymmetry on the resulting flow structure were studied over a range of Reynolds numbers and gas densities. Significant differences were found between the centreline trajectory spreading rate and velocity decay of conventional horizontal round axisymmetric jets issuing through flat plates and the pipeline leak-representative jets considered in the present study. The realistic pipeline jets were always asymmetric and found to deflect about the jet axis in the near field. In the far field it was found that the realistic pipeline leak geometry causes buoyancy effects to dominate much sooner than expected compared to horizontal round jets issuing through flat plates.
Sizing and Operation of a Pure Renewable Energy Based Electric System through Hydrogen
Nov 2021
Publication
Today in order to reduce the increase of the carbon dioxide emissions a large number of renewable energy resources (RES) are already implemented. Considering both the intermittency and uncertainty of the RES the energy storage system (ESS) is still needed for balancing and stabilizing the power system. Among different existing categories of ESS the hydrogen storage systems (HSS) have the highest energy density and are crucial for the RES integration. In addition RES are located in faraway regions and are often transmitted to the terminal consumption center through HVDC (high voltage direct current) due to its lower power loss. In this paper we present a power supply system that achieves low-carbon emissions through combined HSS and HVDC technology. First the combined HSS and the HVDC model are established. Secondly the rule-based strategy for operating the HSS microgrid is presented. Then an operating strategy for a typical network i.e. the pure RES generation station-HVDC transmission-microgrids is demonstrated. Finally the best sizing capacities for all components are found by the genetic algorithm. The results prove the efficiency of the presented sizing approach for a pure RES electric system.
Estimation of Filling Time for Compressed Hydrogen Refueling
Mar 2019
Publication
In order to facilitate the application of hydrogen energy and ensure its safety the compressed hydrogen storage tank on board needs to be full of hydrogen gas within 3 minutes. Therefore to meet this requirement the effects of refueling parameters on the filling time need to be investigated urgently. For the purpose of solving this issue a novel analytical solution of filling time is obtained from a lumped parameter model in this paper. According to the equation of state for real gas and dimensionless numbers Nu and Re the function relationships between the filling time and the refueling parameters are presented. These parameters include initial temperature initial pressure inflow temperature final temperature and final pressure. These equations are used to fit the reference data the results of fitting show good agreement. Then the values of fitting parameters are further utilized so as to verify the validity of these formulas. We believe this study can contribute to control the hydrogen filling time and ensure the safety during fast filling process.
The Crucial Role of the Lewis Number in Jet Ignition
Sep 2011
Publication
During the early phase of the transient process following a hydrogen leak into the atmosphere a contact surface appears separating hot air from cold hydrogen. Locally the interface is approximately planar. Diffusion occurs potentially leading to ignition. This process was analyzed by Lin˜a´n and Crespo (1976) for Lewis number unity and Lin˜a´n and Williams (1993) for Lewis number less than unity. In addition to conduction these processes are affected by expansion due to the flow which leads to a temperature drop. If chemistry is very temperature-sensitive then the reaction rate peaks close to the hot region where relatively little fuel is present. Indeed the Arrhenius rate drops rapidly as temperature drops much more so than fuel concentration. However the small fuel concentration present close to the airrich side depends crucially upon the balance between fuel diffusion and heat diffusion hence the fuel Lewis number. For Lewis number unity the fuel concentration present due to diffusion is comparable to the rate of consumption due to chemistry. If the Lewis number is less than unity fuel concentration brought in by diffusion is large compared with temperature-controlled chemistry. For a Lewis number greater than unity diffusion is not strong enough to bring in as much fuel as chemistry would be able to burn and combustion is controlled by fuel diffusion. In the former case combustion occurs faster leading to a localized ignition at a finite time determined by the analysis. As long as the temperature drop due to the expansion associated with the multidimensional nature of the jet does not lower significantly the reaction rate up to that point ignition in the jet takes place. For fuel Lewis number greater than unity first the reaction rate is much lower. Second chemistry does not lead to a defined ignition. Eventually expansion will affect the process and ignition does not take place. In summary it appears that the reason why hydrogen is the only fuel for which jet ignition has been observed is a Lewis number effect coupled with a high speed of sound hence a high initial temperature discontinuity.
A Dual Zone Thermodynamic Model for Refueling Hydrogen Vehicles
Sep 2017
Publication
With the simple structure and quick refuelling process the compressed hydrogen storage system is currently widely used. However thermal effects during charging-discharging cycle may induce temperature change in storage tank which has significant impact on the performance of hydrogen storage and the safety of hydrogen storage tank. To address this issue we once propose a single zone lumped parameter model to obtain the analytical solution of hydrogen temperature and use the analytical solution to estimate the hydrogen temperature but the effect of the tank wall is ignored. For better description of the heat transfer characteristics of the tank wall a dual zone (hydrogen gas and tank wall) lumped parameter model will be considered for widely representation of the reference (experimental or simulated) data. Now we extend the single zone model to the dual zone model which uses two different temperatures for gas zone and wall zone. The dual zone model contains two coupled differential equations. To solve them and obtain the solution we use the method of decoupling the coupled differential equations and coupling the solutions of the decoupled differential equations. The steps of the method include: (1) Decoupling of coupled differential equations; (2) Solving decoupled differential equations; (3) Coupling of solutions of differential equations; (4) Solving coupled algebraic equations. Herein three cases are taken into consideration: constant inflow/outflow temperature variable inflow/outflow temperature and constant inflow temperature and variable outflow temperature. The corresponding approximate analytical solutions of hydrogen temperature and wall temperature can be obtained. The hydrogen pressure can be calculated from the hydrogen temperature and the hydrogen mass using the equation of state for ideal gas. Besides the two coupled differential equations can also be solved numerically and the simulated solution can also be obtained. This study will help to set up a formula based approach of refuelling protocol for gaseous hydrogen vehicles.
Determination of Clearance Distances for Venting of Hydrogen Storage
Sep 2005
Publication
This paper discusses the results of computational fluid dynamics (CFD) modelling of hydrogen releases and dispersion outdoors during venting of hydrogen storage in real environment and geometry of a hydrogen refuelling or energy station for a given flow rate and dimensions of vent stack. The PHOENICS CFD software package was used to solve the continuity momentum and concentration equations with the appropriate boundary conditions buoyancy model and turbulence models. Also thermal effects resulting from potential ignition of flammable hydrogen clouds were assessed using TNO “Yellow Book” recommended approaches. The obtained results were then applied to determine appropriate clearance distances for venting of hydrogen storage for contribution to code development and station design considerations. CFD modelling of hydrogen concentrations and TNO-based modelling of thermal effects have proven to be reliable effective and relatively inexpensive tools to evaluate the effects of hydrogen releases.
Vertical Turbulent Buoyant Helium Jet - CFD Modelling and Validation
Sep 2005
Publication
In this paper a vertical turbulent round jet of helium was studied numerically using the PHOENICS software package. The flow was assumed to be steady incompressible and turbulent. The jet discharge Froude number was 14000 and the turbulent Schmidt number was 0.7. The incompressible Reynolds average Navier-Stokes equations and helium transport equation expressed in 2-D axisymmetric domain were applied to model the underlying helium release. The k-e RNG turbulence model was used for the calculations of the corresponding turbulent viscosity diffusivity velocity and concentration fields in the domain. The simulation results are compared with the experimental measurements from the earlier published studies on helium jets in non-buoyant jet region (NBJ) intermediate region (I) and buoyant plume region (BP). The numerical results show that the radial profiles of mean velocity and mean concentration are consistent with the empirical data scaled by the effective diameter and density-ratio dependence. The mean velocity and concentration fields along the axis of the jet agree with the decay laws correlated from the previous experiments. The discrepancy between the numerical and experimental data is within 10% proving that the current CFD model for gas release and dispersion is robust accurate and reliable and that the CFD technique can be used as an alternative to the experiments with similar helium jets. The authors believe that the current CFD model is well validated through this study and can be further extended to predict similar hydrogen releases and dispersion if the model is properly applied with hydrogen properties.
Development of Uniform Harm Criteria for Use in Quantitative Risk Analysis of the Hydrogen Infrastructure
Sep 2009
Publication
This paper discusses the preliminary results of the Risk Management subtask efforts within the International Energy Agency (IEA) Hydrogen Implementing Agreement (HIA) Task 19 on Hydrogen Safety to develop uniform harm criteria for use in the Quantitative Risk Assessments (QRAs) of hydrogen facilities. The IEA HIA Task 19 efforts are focused on developing guidelines and criteria for performing QRAs of hydrogen facilities. The performance of QRAs requires that the level of harm that is represented in the risk evaluation be established using deterministic models. The level of harm is a function of the type and level of hazard. The principle hazard associated with hydrogen facilities is uncontrolled accumulation of hydrogen in (semi) confined spaces and consecutive ignition. Another significant hazard is combustion of accidentally released hydrogen gas or liquid which may or may not happen instantaneously. The primary consequences from fire hazards consist of personnel injuries or fatalities or facility and equipment damage due to high air temperatures radiant heat fluxes or direct contact with hydrogen flames. The possible consequences of explosions on humans and structures or equipment include blast wave overpressure effects impact from fragments generated by the explosion the collapse of buildings and the heat effects from subsequent fire balls. A harm criterion is used to translate the consequences of an accident evaluated from deterministic models to a probability of harm to people structures or components. Different methods can be used to establish harm criteria including the use of threshold consequence levels and continuous functions that relate the level of a hazard to a probability of damage. This paper presents a survey of harm criteria that can be utilized in QRAs and makes recommendations on the criteria that should be utilized for hydrogen-related hazards.
Numerical Investigation of Hydrogen Release from Varying Diameter Exit
Sep 2011
Publication
Computational fluid dynamics is used to simulate the release of high pressure Hydrogen from a reservoir with an exit of increasing diameter. Abel-Noble real gas equation of state is used to accurately simulate this high pressure release. Parallel processing based on Message Passing Interface for domain decomposition is employed to decrease the solution time. The release exit boundary is increased in time to simulate a scenario when the exit area increases during the release. All nodes and elements are moved accordingly at each time step to maintain the quality of the mesh. Different speeds of increasing diameter are investigated to see the impact on this unsteady flow.
Synthesis and Performance of Photocatalysts for Photocatalytic Hydrogen Production: Future Perspectives
Dec 2021
Publication
Photocatalysis for “green” hydrogen production is a technology of increasing importance that has been studied using both TiO2–based and heterojunction composite-based semiconductors. Different irradiation sources and reactor units can be considered for the enhancement of photocatalysis. Current approaches also consider the use of electron/hole scavengers organic species such as ethanol that are “available” in agricultural waste in communities around the world. Alternatively organic pollutants present in wastewaters can be used as organic scavengers reducing health and environmental concerns for plants animals and humans. Thus photocatalysis may help reduce the carbon footprint of energy production by generating H2 a friendly energy carrier and by minimizing water contamination. This review discusses the most up-to-date and important information on photocatalysis for hydrogen production providing a critical evaluation of: (1) The synthesis and characterization of semiconductor materials; (2) The design of photocatalytic reactors; (3) The reaction engineering of photocatalysis; (4) Photocatalysis energy efficiencies; and (5) The future opportunities for photocatalysis using artificial intelligence. Overall this review describes the state-of-the-art of TiO2–based and heterojunction composite-based semiconductors that produce H2 from aqueous systems demonstrating the viability of photocatalysis for “green” hydrogen production.
Numerical Investigation of a Vertical Surface on the Flammable Extent of Hydrogen and Methane Vertical Jets
Sep 2011
Publication
The effect of vertical surface on the extent of high pressure unignited jets of both hydrogen and methane is studied using computer fluid dynamics simulations performed with FLACS Hydrogen. Results for constant flow rate through a 6.35 mm round leak orifice from 100 barg 250 barg 400 barg 550 barg and 700 barg compressed gas systems are presented for vertical jets. To quantify the effect of the surface on the jet the jet exit is positioned at various distances from the surface ranging from 0.029 m to 12 m. Free jets simulations are performed for comparison purposes.
Numerical and Experimental Investigation of Buoyant Gas Release
Sep 2009
Publication
Buoyant round vertical jet had been investigated using Large Eddy Simulations at low Mach number. For the purpose of comparison with in-house experimental data in the present work helium has been used as a substitute for hydrogen. The influence of the transient concentration fields on the volume of gas with concentration within flammability limits has been investigated and their evolution and relation with average fields ad been characterized. Transient concentration fields created during initial jet development had been considered. Numerical results have been compared with in-house experiments and data published in the literature.
Numerical Investigation of Subsonic Hydrogen Jet Release
Sep 2011
Publication
A buoyant round vertical hydrogen jet is investigated using Large Eddy Simulations at low Mach number (M = 0.3). The influence of the transient concentration fields on the extent of the gas envelope with concentrations within the flammability limits is analyzed and their structure are characterized. The transient flammable region has a complex structure that extends up to 30% beyond the time-averaged flammable volume with high concentration pockets that persist sufficiently long for potential ignition. Safety envelopes devised on the basis of simplified time-averaged simulations would need to include a correction factor that accounts for transient incursions of high flammability concentrations.
State-of-the-Art and Research Priorities in Hydrogen Safety
Sep 2013
Publication
On October 16-17 2012 the International Association for Hydrogen Safety (HySafe) in cooperation with the Institute for Energy and Transport of the Joint Research Centre of the European Commission (JRC IET Petten) held a two-day workshop dedicated to Hydrogen Safety Research Priorities. The workshop was hosted by Federal Institute for Materials Research and Testing (BAM) in Berlin Germany. The main idea of the Workshop was to bring together stakeholders who can address the existing knowledge gaps in the area of the hydrogen safety including identification and prioritization of such gaps from the standpoint of scientific knowledge both experimental and theoretical including numerical. The experience highlighting these gaps which was obtained during both practical applications (industry) and risk assessment should serve as reference point for further analysis. The program included two sections: knowledge gaps as they are addressed by industry and knowledge gaps and state-of-the-art by research. In the current work the main results of the workshop are summarized and analysed.
Effects of Chemical Kinetics on Ignition of Hydrogen Jets
Sep 2013
Publication
During the early phase of the transient process following a hydrogen leak into the atmosphere a contact surface appears separating air heated by the leading shock from hydrogen cooled by expansion. Locally the interface is approximately planar. Diffusion leads to a temperature decrease on the air side and an increase in the hydrogen-filled region and mass diffusion of hydrogen into air and of air into hydrogen potentially resulting in ignition. This process was analyzed by Li ˜nan and Crespo [1] for unity Lewis number and Li ˜nan and Williams [2] for Lewis number less than unity. We included in the analysis the effect of a slow expansion [3 4] leading to a slow drop in temperature which occurs in transient jets. Chemistry being very temperature-sensitive the reaction rate peaks close to the hot side of the interface where only a small fuel concentration present close to the warm air-rich side which depends crucially upon the fuel Lewis number. For Lewis number unity the fuel concentration due to diffusion is comparable to the rate of consumption by chemistry. If the Lewis number is less than unity diffusion brings in more fuel than temperature-controlled chemistry consumes. For a Lewis number greater than unity diffusion is not strong enough to bring in as much fuel as chemistry would burn; combustion is controlled by fuel diffusion. If the temperature drop due to expansion associated with the multidimensional jet does not lower significantly the reaction rate up to that point analysis shows that ignition in the jet takes place. For fuel Lewis number greater than unity chemistry does not lead to a defined explosion so that eventually expansion will affect the process; ignition does not take place [3 4]. In the current paper these results are extended to consider multistep chemical kinetics but for otherwise similar assumptions. High activation energy is no longer applicable. Instead results are obtained in the short time limit still as a perturbation superimposed to the self-similar solution to the chemically frozen diffusion solution. In that approximation the initiation step which consumes fuel and oxidant is taken to be slow compared with steps that consume one of the reactants and an intermediate species. The formulation leads to a two point boundary value problem for set of coupled rate equations plus an energy equation for perturbations. These equations are linear with variable co-effcients. The coupled problem is solved numerically using a split algorithm in which chemical reaction is solved for frozen diffusion while diffusion is solved for frozen chemistry. At each time step the still coupled linear problem is solved exactly by projecting onto the eigenmodes of the stiff matrix so that the solution is unaffected by stiffness. Since in the short time limit temperature is only affected at the perturbation level the matrix depends only on the similarity variable x t but it is otherwise time-independent. As a result determination of the eigenvalues and eigenvectors is only done once (using Maple) for the entire range of discretized values of the similarity variable. The diffusion problem consists of a set of independent equations for each species. Each of these is solved using orthogonal decomposition onto Hermite polynomials for the homogeneous part plus a particular solution proportional to time for the non-homogeneous (source) terms. That approach can be implemented for different kinetic schemes.
Boundary Layer Effects on the Critical Nozzle of Hydrogen Sonic Jet
Oct 2015
Publication
When hydrogen flows through a small finite length constant exit area nozzle the viscous effects create a fluid throat which acts as a converging-diverging nozzle and lead to Mach number greater than one at the exit if the jet is under-expanded. This phenomenon influences the mass flow rate and the dispersion cloud size. In this study the boundary layer effect on the unsteady hydrogen sonic jet flow through a 1 mm diameter pipe from a high pressure reservoir (up to 70 MPa) is studied using computational fluid dynamics with a large eddy simulation turbulence model. This viscous flow simulation is compared with a non-viscous simulation to demonstrate that the velocity is supersonic at the exit of a small exit nozzle and that the mass flow is reduced.
Heat Transfer Analysis for Fast Filling of On-board Hydrogen Tank
Mar 2019
Publication
The heat transfer analysis in the filling process of compressed on-board hydrogen storage tank has been the focus of hydrogen storage research. The initial conditions mass flow rate and heat transfer coefficient have certain influence on the hydrogen filling performance. In this paper the effects of mass flow rate and heat transfer coefficient on hydrogen filling performance are mainly studied. A thermodynamic model of the compressed hydrogen storage tank was established by Matlab/Simulink. This 0D model is utilized to predict the hydrogen temperature hydrogen pressure tank wall temperature and SOC (State of Charge) during filling process. Comparing the simulated results with the experimental data the practicability of the model can be verified. The simulated results have certain meaning for improving the hydrogenation parameters in real filling process. And the model has a great significance to the study of hydrogen filling and purification.
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