Publications

A series of experiments were performed in the SPARC (spray-aerosol-recombiner-combustion) test facility to simulate a hydrogen mitigation system with the actuation of a PAR (passive auto-catalytic re-combiner) and spray system. In this study the SPARC-SPRAY-PAR (SSP1) experiment is chosen to benchmark the MELCOR (a lumped-parameter code for severe accident analysis) predictions against test data. For this purpose firstly we prepared the base input model of the SPARC test vessel and tested it by a simple verification problem with well-defined boundary conditions. The implementation of a currently used PAR correlation in MELCOR is shown to be appropriate for the simulation of a PAR actuation experiment. In an SSP1 experiment the PAR is reacting with hydrogen and the spray actuation starts as soon as hydrogen injection is complete. The MELCOR simulation well predicts the pressure behavior and the gas flow affected by operating both a PAR and spray system. However the local hydrogen concentration measurement near the inlet nozzle is much higher than the volume average-value by MELCOR since high jet flow from the nozzle is dispersed in the corresponding cell volume. The experimental reproduction of the phenomena we expect or conversely the identification of phenomena we do not understand will continue to support the verification of analytical models using experimental data and to analyze the impact of spray on PAR operations in severe accident conditions.

The establishment of a strong hydrogen economy nationally and locally is a very real opportunity and one that is rapidly becoming within reach.<br/>This report presents a vision for the role that hydrogen could play specifically in South Yorkshire (UK) to help meet carbon reduction targets and contribute to the health and economic prosperity of the region.<br/>It also highlights five themes as levers of growth and explores potential actions and collaborations as well as a list of ambitions for future hydrogen projects. Hydrogen can be used in transport industry and heating. Synergies need exploring for example the by-product of oxygen from hydrogen production can be used by industry. Aggregating opportunities is important in developing a hydrogen economy.<br/>The report concludes with a call to action to build momentum for the South Yorkshire hydrogen economy and accelerate the drive to net zero emissions particularly in the most challenging sectors.<br/>This South Yorkshire specific report supports our global thought piece Establishing a Hydrogen Economy: The future of energy 2035

Energy storage is a promising approach to address the challenge of intermittent generation from renewables on the electric grid. In this work we evaluate energy storage with a regenerative hydrogen fuel cell (RHFC) using net energy analysis. We examine the most widely installed RHFC configuration containing an alkaline water electrolyzer and a PEM fuel cell. To compare RHFC's to other storage technologies we use two energy return ratios: the electrical energy stored on invested (ESOI_e) ratio (the ratio of electrical energy returned by the device over its lifetime to the electrical-equivalent energy required to build the device) and the overall energy efficiency (the ratio of electrical energy returned by the device over its lifetime to total lifetime electrical-equivalent energy input into the system). In our reference scenario the RHFC system has an ESOI_eratio of 59 more favorable than the best battery technology available today (Li-ion ESOI_e= 35). (In the reference scenario RHFC the alkaline electrolyzer is 70% efficient and has a stack lifetime of 100 000 h; the PEM fuel cell is 47% efficient and has a stack lifetime of 10 000 h; and the round-trip efficiency is 30%.) The ESOIe ratio of storage in hydrogen exceeds that of batteries because of the low energy cost of the materials required to store compressed hydrogen and the high energy cost of the materials required to store electric charge in a battery. However the low round-trip efficiency of a RHFC energy storage system results in very high energy costs during operation and a much lower overall energy efficiency than lithium ion batteries (0.30 for RHFC vs. 0.83 for lithium ion batteries). RHFC's represent an attractive investment of manufacturing energy to provide storage. On the other hand their round-trip efficiency must improve dramatically before they can offer the same overall energy efficiency as batteries which have round-trip efficiencies of 75–90%. One application of energy storage that illustrates the trade-off between these different aspects of energy performance is capturing overgeneration (spilled power) for later use during times of peak output from renewables. We quantify the relative energetic benefit of adding different types of energy storage to a renewable generating facility using [EROI]grid. Even with 30% round-trip efficiency RHFC storage achieves the same [EROI]grid as batteries when storing overgeneration from wind turbines because its high ESOI_eratio and the high EROI of wind generation offset the low round-trip efficiency.

The production of hydrogen through water splitting in a photoelectrochemical cell suffers from an overpotential that limits the efficiencies. In addition hydrogen-peroxide formation is identified as a competing process affecting the oxidative stability of photoelectrodes. We impose spin-selectivity by coating the anode with chiral organic semiconductors from helically aggregated dyes as sensitizers; Zn-porphyrins and triarylamines. Hydrogen peroxide formation is dramatically suppressed while the overall current through the cell correlating with the water splitting process is enhanced. Evidence for a strong spin-selection in the chiral semiconductors is presented by magnetic conducting (mc-)AFM measurements in which chiral and achiral Zn-porphyrins are compared. These findings contribute to our understanding of the underlying mechanism of spin selectivity in multiple electron-transfer reactions and pave the way toward better chiral dye-sensitized photoelectrochemical cells.

A series of molecular rotors was designed to study and measure the rate accelerating effects of an intramolecular hydrogen bond. The rotors form a weak neutral O–H⋯O[double bond length as m-dash]C hydrogen bond in the planar transition state (TS) of the bond rotation process. The rotational barrier of the hydrogen bonding rotors was dramatically lower (9.9 kcal mol⁻¹) than control rotors which could not form hydrogen bonds. The magnitude of the stabilization was significantly larger than predicted based on the independently measured strength of a similar O–H⋯O[double bond length as m-dash]C hydrogen bond (1.5 kcal mol⁻¹). The origins of the large transition state stabilization were studied via experimental substituent effect and computational perturbation analyses. Energy decomposition analysis of the hydrogen bonding interaction revealed a significant reduction in the repulsive component of the hydrogen bonding interaction. The rigid framework of the molecular rotors positions and preorganizes the interacting groups in the transition state. This study demonstrates that with proper design a single hydrogen bond can lead to a TS stabilization that is greater than the intrinsic interaction energy which has applications in catalyst design and in the study of enzyme mechanisms.

Hydrogen energy as a clean and renewable energy has attracted much attention in recent years. Water electrolysis via the hydrogen evolution reaction at the cathode coupled with the oxygen evolution reaction at the anode is a promising method to produce hydrogen. Given the shortage of freshwater resources on the planet the direct use of seawater as an electrolyte for hydrogen production has become a hot research topic. Direct use of seawater as the electrolyte for water electrolysis can reduce the cost of hydrogen production due to the great abundance and wide availability. In recent years various high-efficiency electrocatalysts have made great progress in seawater splitting and have shown great potential. This review introduces the mechanisms and challenges of seawater splitting and summarizes the recent progress of various electrocatalysts used for hydrogen and oxygen evolution reaction in seawater electrolysis in recent years. Finally the challenges and future opportunities of seawater electrolysis for hydrogen and oxygen production are presented.

The carbide characteristics of 2.25Cr1Mo0.25V steel have an extremely important influence on the mechanical properties of welding joints. In addition hydrogen resistance behavior is crucial for steel applied in hydrogenation reactors. The carbide morphology was observed by scanning electron microscopy (SEM) and the carbide microstructure was characterized by transmission electron microscopy (TEM). Tensile and impact tests were carried out and the influence of carbides on properties was studied. A hydrogen diffusion test was carried out and the hydrogen brittleness resistance of welding metal and base metal was studied by tensile testing of hydrogenated samples to evaluate the influence of hydrogen on the mechanical properties. The research results show that the strength of the welding metal was slightly higher and the Charpy impact value was significantly lower compared to the base metal. The hydrogen embrittlement resistance of the welding metal was stronger than that of the base metal. The presence of more carbides and inclusions was the main cause of the decreased impact property and hydrogen brittleness resistance of the welding metal. These conclusions have certain reference value for designing and manufacturing hydrogenation reactors. View Full-Text

The combination of offshore wind and green hydrogen provides major opportunities for job creation economic growth and regional regeneration as well as attracting inward investment alongside delivering the emission reductions needed to achieve climate neutrality. In order to get to Net Zero emissions in 2050 the UK is likely to need a minimum of 75GW of offshore wind (OSW) and modelling of the energy system indicates that hydrogen will play a major role in integrating the high levels of OSW on the electricity grid.<br/><br/>Some of the key findings from report are listed below:<br/><br/>The UK has vast resources of offshore wind with the potential for over 600GW in UK waters and potentially up to 1000GW. This is well above the he figure of 75-100GW likely to be needed for UK electricity generation by 2050.<br/>The universities in the UK provide the underpinning science and engineering for electrolysers fuel cells and hydrogen and are home to world-leading capability in these areas.<br/>In order to achieve cost reduction and growing a significant manufacturing and export industry it will be crucial to develop green hydrogen in the next 5 years<br/>By 2050 green hydrogen can be cheaper than blue hydrogen. With accelerated deployment green hydrogen costs can be competitive with blue hydrogen by the eary 2030s.<br/>The combination of additional OSW deployment and electrolyser manufacture alone could generate over 120000 new jobs. These are are expected to be based mainly in manufacturing OSW-related activity shipping and mobility<br/>By 2050 it is estimated that the cumulative gross value added (GVA) from supply of electrolysers and additional OSW farm could be up to £320bn where the majority will come from exports of electrolysers to overseas markets.<br/>The report also calls for immediate government intervention and a new national strategy to support the creation of supply and demand in the new industry.<br/><br/>This study was jointly supported by the Offshore Wind Industry Council (OWIC) and ORE Catapult.

Green hydrogen has been known in the UK since Robert Boyle described flammable air in 1671. This paper describes how green hydrogen has become a new priority for the UK in 2021 beginning to replace fossil hydrogen production exceeding 1 Mte in 2021 when the British Government started to inject significant funding into green hydrogen sources though much less than the USA Germany Japan and China. Recent progress in the UK was initiated in 2008 when the first UK green hydrogen station opened in Birmingham University refuelling 5 hydrogen fuel cell battery electric vehicles (HFCBEVs) for the 50 PhD chemical engineering students that arrived in 2009. Only 10 kg/day were required in contrast to the first large green ITM power station delivering almost 600 kg/day of green hydrogen that opened in the UK in Tyseley in July 2021. The first question asked in this paper is: ‘What do you mean Green?’. Then the Clean Air Zone (CAZ) in Birmingham is described with the key innovations defined. Progress in UK green hydrogen and fuel cell introduction is then recounted. The remarks of Elon Musk about this ‘Fool Cell; Mind bogglingly stupid’ technology are analysed to show that he is incorrect. The immediate deployment of green hydrogen stations around the UK has been planned. Another century may be needed to make green hydrogen dominant across the country yet we will be on the correct path once a profitable supply chain is established in 2022.

While significant increase in turbulent burning rate in lean premixed flames of hydrogen or hydrogen-containing fuel blends is well documented in various experiments and can be explained by highlighting local diffusional-thermal effects capabilities of the vast majority of available models of turbulent combustion for predicting this increase have not yet been documented in numerical simulations. To fill this knowledge gap a well-validated Turbulent Flame Closure (TFC) model of the influence of turbulence on premixed combustion which however does not address the diffusional-thermal effects is combined with the leading point concept which highlights strongly perturbed leading flame kernels whose local structure and burning rate are significantly affected by the diffusional-thermal effects. More specifically within the framework of the leading point concept local consumption velocity is computed in extremely strained laminar flames by adopting detailed combustion chemistry and subsequently the computed velocity is used as an input parameter of the TFC model. The combined model is tested in RANS simulations of highly turbulent lean syngas-air flames that were experimentally investigated at Georgia Tech. The tests are performed for four different values of the inlet rms turbulent velocities different turbulence length scales normal and elevated (up to 10 atm) pressures various H₂/CO ratios ranging from 30/70 to 90/10 and various equivalence ratios ranging from 0.40 to 0.80. All in all the performed 33 tests indicate that the studied combination of the leading point concept and the TFC model can predict well-pronounced diffusional-thermal effects in lean highly turbulent syngas-air flames with these results being obtained using the same value of a single constant of the combined model in all cases. In particular the model well predicts a significant increase in the bulk turbulent consumption velocity when increasing the H₂/CO ratio but retaining the same value of the laminar flame speed.