Publications

The co-combustion of diesel fuel with H2 presents a promising route to reduce the adverse effects of diesel engine exhaust pollutants on the environment and human health. This paper presents the results of H2-diesel co-combustion experiments carried out on two different research facilities a light duty and a heavy duty diesel engine. For both engines H2 was supplied to the engine intake manifold and aspirated with the intake air. H2 concentrations of up to 20% vol/vol and 8% vol/vol were tested in the light duty and heavy duty engines respectively. Exhaust gas circulation (EGR) was also utilised for some of the tests to control exhaust NOx emissions.<br/>The results showed NOx emissions increase with increasing H2 in the case of the light duty engine however in contrast for the heavy duty engine NOx emissions were stable/reduced slightly with H2 attributable to lower in-cylinder gas temperatures during diffusion-controlled combustion. CO and particulate emissions were observed to reduce as the intake H2 was increased. For the light duty H2 was observed to auto-ignite intermittently before diesel fuel injection had started when the intake H2 concentration was 20% vol/vol. A similar effect was observed in the heavy duty engine at just over 8% H2 concentration.

The different CFD tools used by the NoE HySafe partners are applied to a series of integral complex Standard Benchmark Exercise Problems (SBEPs). All benchmarks cover complementarily physical phenomena addressing application relevant scenarios and refer to associated experiments with an explicit usage of hydrogen. After the blind benchmark SBEPV1 and SBEPV3 with subsonic vertical release in a large vessel and in a garage like facility SBEPV4 with a horizontal under-expanded jet release through a small nozzle SBEPV5 covers the scenario of a subsonic horizontal jet release in a multi-compartment room.<br/>As the associated dispersion experiments conducted by GEXCON Norsk Hydro and STATOIL were disclosed to the participants the whole benchmark was conducted openly. For the purpose of validation only the low momentum test D27 had to be simulated.<br/>The experimental rig consists of a 1.20 m x 0.20 m x 0.90 m (Z vertical) vessel divided into 12 compartments partially even physically by four baffle plates. In each compartment a hydrogen concentration sensor is mounted. There is one vent opening at the wall opposite the release location centrally located about 1 cm above floor with dimensions 0.10 m (Y) times 0.20 m (Z). The first upper baffle plate close to the release point is on a sensitive location as it lies nearly perfectly in the centre of the buoyant jet and thus separates the flow into the two compartments. The actual release was a nominally constant flow of 1.15 norm liters for 60 seconds. With a 12mm nozzle diameter this corresponds to an average exit velocity of 10.17 m/s.<br/>6 CFD packages have been applied by 7 HySafe partners to simulate this experiment: ADREAHF by NCSRD FLACS by GexCon and DNV KFX by DNV FLUENT by UPM and UU CFX by HSE/HSL and GASFLOW by FZK. The results of the different participants are compared against the experimental data. Sensitivity studies were conducted by FZK using GASFLOW and by DNV applying KFX.<br/>Conclusions based on the comparisons and the sensitivity studies related to the performance of the applied turbulence models and discretisation schemes in the release and diffusion phase are proposed. These are compared to the findings of the previous benchmark exercises.

An experimental study of flame propagation acceleration and transition to detonation in hydrogen-air mixture in 2 m long rectangular cross section channel filled with obstacles located at the bottom wall was performed. The initial conditions of the hydrogen-air mixture were 0.1 MPa and 293 K. Three different cases of obstacle height (blockage ratio 0.25 0.5 and 0.75) and four cases of obstacle density were studied with the channel height equal to 0.08 m. The channel width was 0.11 m in all experiments. The propagation of flame and pressure waves was monitored by four pressure transducers and four in house ion probes. The pairs of transducers and probes were placed at various locations along the channel in order to get information about the progress of the phenomena along the channel. To examine the influence of mixture composition on flame propagation and DDT the experiments were performed for the compositions of 20% 25% and 29.6% of H2 in air by volume. As a result of the experiments the deflagration and detonation regimes and velocities of flame propagation in the obstructed channel were determined.

This study deals with the TNO Multi-Energy and Baker-Strehlow-Tang (BST) methods for estimating the positive overpressures and positive impulses resulting from hydrogen-air explosions. With these two methods positive overpressure and positive impulse results depend greatly on the choice of the class number for the TNO Multi-Energy method or the Mach number for the BST methods. These two factors permit the user to read the reduced parameters of the blast wave from the appropriate monographs for each of these methods i.e. positive overpressure and positive duration phase for the TNO Multi-Energy method and positive overpressure and positive impulse for the BST methods. However for the TNO Multi-Energy method the determination of the class number is not objective because it is the user who makes the final decision in choosing the class number whereas with the BST methods the user is strongly guided in their choice of an appropriate Mach number. These differences in the choice of these factors can lead to very different results in terms of positive overpressure and positive impulse. Therefore the objective of this work was to compare the positive overpressures and positive impulses predicted with the TNO Multi-Energy and BST methods with data available from large-scale experiments.

In this work first-principles methods were performed to simulate interactions between hydrogen and common alloying elements of high strength low alloy (HSLA) steel. The world has been convinced that hydrogen could be one of the future clean energy sources. HSLA steel with a balance of strength toughness and hydrogen embrittlement susceptibility is expected for application in large-scale hydrogen storage and transportation. To evaluate the property deterioration under a hydrogen atmosphere hydrogen embrittlement (HE) of HSLA steel attracts attention. However due to the small size of hydrogen atoms the mechanism of HE is challenging to observe directly by current experimental methods. To understand the HE mechanism at an atomic level DFT methods were applied to simulate the effects of alloying elements doping in bcc-Fe bulk structure and grain boundary structure. Furthermore the potential application of DFT to provide theoretical advice for HSLA steel design is discussed.

The study of steels which guarantee safety and reliability throughout their service life in hydrogen-rich environments has increased considerably in recent years. Their mechanical behavior in terms of hydrogen embrittlement is of utmost importance. This work aims to assess the effects of hydrogen on the tensile properties of quenched and tempered 42CrMo4 steels. Tensile tests were performed on smooth and notched specimens under different conditions: pre-charged in high pressure hydrogen gas electrochemically pre-charged and in-situ hydrogen charged in an acid aqueous medium. The influence of the charging methodology on the corresponding embrittlement indexes was assessed. The role of other test variables such as the applied current density the electrolyte composition and the displacement rate was also studied. An important reduction of the strength was detected when notched specimens were subjected to in-situ charging. When the same tests were performed on smooth tensile specimens the deformation results were reduced. This behavior is related to significant changes in the operative failure micromechanisms from ductile (microvoids coalescence) in absence of hydrogen or under low hydrogen contents to brittle (decohesion of martensite lath interfaces) under the most stringent conditions.

We analytically investigated the influence of light hydrocarbons on turbulent premixed H2/air atmospheric flames under lean conditions in view of safe handling of H2 systems applications in H2 powered IC engines and gas turbines and also with an orientation towards modelling of H2 combustion. For this purpose an algebraic flame surface wrinkling model included with pressure and fuel type effects is used. The model predictions of turbulent premixed flames are compared with the set of corresponding experimental data of Kido et al. (Kido Nakahara et al. 2002). These expanding spherical flame data include H2–air mixtures doped with CH4 and C3H8 while the overall equivalence ratio of all the fuel/air mixtures is fixed at 0.8 for constant unstretched laminar flame speed of 25 cm/s by varying N2 composition. The model predictions show that there is little variation in turbulent flame speed ST for C3H8 additions up to 20-vol%. However for 50 vol% doping flame speed decreases by as much as 30 % from 250 cm/s that of pure H2–air mixtures for turbulence intensity of 200 cm/s. With respect to CH4 for 50 vol% doping ST reduces by only 6 % cf. pure H2/air mixture. In the first instance the substantial decrease of ST with C3H8 addition may be attributed to the increase in the Lewis number of the dual-fuel mixture and proportional restriction of molecular mobility of H2. That is this decrease in flame speed can be explained using the concept of leading edges of the turbulent flame brush (Lipatnikov and Chomiak 2005). As these leading edges have mostly positive curvature (convex to the unburned side) preferential-diffusive-thermal instabilities cause recognizable impact on flame speed at higher levels of turbulence with the effect being very strong for lean H2 mixtures. The lighter hydrocarbon substitutions tend to suppress the leading flame edges and possibly transition to detonation in confined structures and promote flame front stability of lean turbulent premixed flames. Thus there is a necessity to develop a predictive reaction model to quantitatively show the strong influence of molecular transport coefficients on ST.

We report the development and testing of a novel hydrogen sensor that shows a very peculiar response to hydrogen exposure due to its micro-structured palladium surface. The fabrication of the wrinkled Pd surface is obtained using an innovative fast and cheap technique based on the deposition of a thin Pd film on to a thermo-retractable polystyrene sheet that shrinks to 40% of its original size when heated. The buckling of the Pd surface induced by shrinking of the substrate produces nano and micro-wrinkles on the sensor surface. The micro-structured sensor surface is very stable even after repeated hydrogen sorption/desorption cycles. The hydrogen sensing mechanism is based on the transitory absorption of hydrogen atoms into the Pd layer leading to the reversible change of its electrical resistance. Interestingly depending on hydrogen concentration the proposed sensor shows the concurrent effect of both the usually described behaviors of increase or decrease of resistance related to different phenomena occurring upon hydrogen exposure and formation of palladium hydride. The study reports and discusses evidences for an activation threshold of hydrogen concentration in air switching the behavior of sensor performances from e.g. poor negative to large positive sensitivity and from slow to fast detection.

Production of iron and steel releases seven percent of the global greenhouse gas (GHG) emissions. Incremental changes in present primary steel production technologies would not be sufficient to meet the emission reduction targets. Replacing coke used in the blast furnaces as a reducing agent with hydrogen produced from water electrolysis has the potential to reduce emissions from iron and steel production substantially. Mass and energy flow model based on an open-source software (Python) has been developed in this work to explore the feasibility of using hydrogen direct reduction of iron ore (HDRI) coupled with electric arc furnace (EAF) for carbon-free steel production. Modeling results show that HDRI-EAF technology could reduce specific emissions from steel production in the EU by more than 35% at present grid emission levels (295 kgCO2/MWh). The energy consumption for 1 ton of liquid steel (tls) production through the HDRI-EAF route was found to be 3.72 MWh which is slightly more than the 3.48 MWh required for steel production through the blast furnace (BF) basic oxygen furnace route (BOF). Pellet making and steel finishing processes have not been considered. Sensitivity analysis revealed that electrolyzer efficiency is the most important factor affecting the system energy consumption while the grid emission factor is strongly correlated with the overall system emissions.

A study of open literature was performed to determine the effects of high hydrogen purity and gas pressure (in the range of 700-1000 bar) on the hydrogen embrittlement of several metallic materials. A particular focus was given to carbon low-alloy and stainless steels but information on embrittlement of aluminum and copper was included in the study. Additionally the most common test methods were studied and results from similar tests are presented in a manner so as to simplify comparisons of materials. Finally suggestions are provided for future testing necessary to ensure the safety of hydrogen storage at 700 bar.