United States

In this study the consequences of an accidental release of hydrogen within large scale (>15000 m3) facilities were modelled. To model the hydrogen release an LES Navier–Stokes CFD solver called fireFoam was used to calculate the dispersion and mixing of hydrogen within a large scale facility. The performance of the CFD modelling technique was evaluated through a validation study using experimental results from a 1/6 scale hydrogen release from the literature and a grid sensitivity study. Using the model a parametric study was performed varying release rates and enclosure sizes and examining the concentrations that develop. The hydrogen dispersion results were then used to calculate the corresponding pressure loads from hydrogen-air deflagrations in the facility.

Geodesign is a participatory planning approach in which stakeholders use geographic information systems to develop and vet alternative design scenarios in a collaborative and iterative process. This study is based on a 2019 geodesign workshop in which 17 participants from industry government university and non-profit sectors worked together to design an initial network of hydrogen refueling stations in the Hartford Connecticut metropolitan area. The workshop involved identifying relevant location factors rapid prototyping of station network designs and developing consensus on a final design. The geodesign platform which was designed specifically for facility location problems enables breakout groups to add or delete stations with a simple point-and-click operation view and overlay different map layers compute performance metrics and compare their designs to those of other groups. By using these sources of information and their own expert local knowledge participants recommended six locations for hydrogen refueling stations over two distinct phases of station installation. We quantitatively and qualitatively compared workshop recommendations to solutions of three optimal station location models that have been used to recommend station locations which minimize travel times from stations to population and traffic or maximize trips that can be refueled on origin–destination routes. In a post-workshop survey participants rated the workshop highly for facilitating mutual understanding and information sharing among stakeholders. To our knowledge this workshop represents the first application of geodesign for hydrogen refueling station infrastructure planning.

Natural gas (Methane) is currently the primary source of catalytic hydrogen production accounting for three quarters of the annual global dedicated hydrogen production (about 70 M tons). Steam–methane reforming (SMR) is the currently used industrial process for hydrogen production. However the SMR process suffers with insufficient catalytic activity low long-term stability and excessive energy input mostly due to the handling of large amount of CO2 coproduced. With the demand for anticipated hydrogen production to reach 122.5 M tons in 2024 novel and upgraded catalytic processes are desired for more effective utilization of precious natural resources. In this review we summarized the major descriptors of catalyst and reaction engineering of the SMR process and compared the SMR process with its derivative technologies such as dry reforming with CO2 (DRM) partial oxidation with O2 autothermal reforming with H2O and O2. Finally we discussed the new progresses of methane conversion: direct decomposition to hydrogen and solid carbon and selective oxidation in mild conditions to hydrogen containing liquid organics (i.e. methanol formic acid and acetic acid) which serve as alternative hydrogen carriers. We hope this review will help to achieve a whole picture of catalytic hydrogen production from methane.

Photoelectrochemical (PEC) water splitting is a promising technology for solar hydrogen production to build a sustainable renewable and clean energy economy. Given the complexity of the PEC water splitting processes it is important to note that developing in-situ techniques for studying PEC water splitting presents a formidable challenge. This review is aimed at highlighting advantages and disadvantages of each technique while offering a pathway of potentially combining several techniques to address different aspects of interfacial processes in PEC water splitting. We reviewed recent progress in various techniques and approaches utilized to study PEC water splitting focusing on spectroscopic and scanning-probe methods.

This US Hydrogen Road Map was created through the collaboration of executives and technical industry experts in hydrogen across a broad range of applications and sectors who are committed to improving the understanding of hydrogen and how to increase its adoption across many sectors of the economy. For the first time this coalition of industry leaders has convened to develop a targeted holistic approach for expanding the use of hydrogen as an energy carrier. Due to great variation among national and state policies infrastructure needs and community interests each state and region of the US will likely have its own specific policies and road maps for implementing hydrogen infrastructure. The West Coast for example has traditionally had progressive policies on reducing transportation emissions so it is likely that hydrogen will scale sooner for vehicles in this region especially California. Experts also acknowledge the role that hydrogen in combination with renewables can play in supplying microgrid-type power to communities with the highest risk of shut-offs during seasonal weather-related issues such as high temperatures or wildfire-related power interruptions. Some states have emphasized the need to decarbonize the gas grid so blending hydrogen in natural gas networks and using hydrogen as feedstock may advance more quickly in these regions. Other states are interested in hydrogen as a means to address power grid issues enable the deployment of renewables and support competitive nuclear power. The launch of hydrogen technologies in some states or regions will help to scale hydrogen in various applications across the country laying the foundation for energy security grid resiliency economic growth and the reduction of both greenhouse gas (GHG) emissions and air pollutants. This report outlines the benefits and impact of fuel cell technologies and hydrogen as a viable solution to the energy challenges facing the US through 2030 and beyond. As such it can serve as the latest comprehensive industry-driven national road map to accelerate and scale up hydrogen in the economy across North America

The availability of repair garage infrastructure for hydrogen fuel cell vehicles is becoming increasingly important for future industry growth. Ventilation requirements for hydrogen fuel cell vehicles can affect both retrofitted and purpose-built repair garages and the costs associated with these requirements can be significant. A hazard and operability (HAZOP) study was performed to identify key risk-significant scenarios related to hydrogen vehicles in a repair garage. Detailed simulations and modeling were performed using appropriate computational tools to estimate the location behaviour and severity of hydrogen release based on key HAZOP scenarios. This work compares current fire code requirements to an alternate ventilation strategy to further reduce potential hazardous conditions. It is shown that position direction and velocity of ventilation have a significant impact on the amount of flammable mass in the domain.

The present study describes hydrogen generation from N_aBH₄ in the presence of acid accelerator boric oxide or  B₂O₃ using seawater as a reactant. Reaction times and temperatures are adjusted using various delivery methods: bulk addition funnel and metering pump. It is found that the transition metal catalysts typically used to generate hydrogen gas are poisoned by seawater. B₂O₃ is not poisoned by seawater; in fact reaction times are considerably faster in seawater using  B₂O₃. Reaction times and temperatures are compared for pure water and seawater for each delivery method. It is found that using B2O3 with pure water bulk addition is 97% complete in 3 min; pump metering provides a convenient method to extend the time to 27 min a factor of 9 increase above bulk addition. Using  B₂O₃ with seawater as a reactant bulk addition is 97% complete in 1.35 min; pump metering extends the time to 23 min a factor of 17 increase above bulk. A second acid accelerator sodium bisulfate or NaHSO4 is investigated here for use with NaBH4 in seawater. Because it is non-reactive in seawater i.e. no spontaneous H₂ generation NaHSO₄ can be stored as a solution in seawater; because of its large solubility it is ready to be metered into NaBH₄. With N_aHSO₄ in seawater pump metering increases the time to 97% completion from 3.4 min to 21 min. Metering allows the instantaneous flow rate of H₂ and reaction times and temperatures to be tailored to a particular application. In one application the seawater hydrogen generator characterized here is ideal for supplying H₂ gas directly to Proton Exchange Membrane fuel cells in sea surface or subsea environments where a reliable source of power is needed.

Guidance on Sensor Placement was identified as the top research priority for hydrogen sensors at the 2018 HySafe Research Priority Workshop on hydrogen safety in the category Mitigation Sensors Hazard Prevention and Risk Reduction. This paper discusses the initial steps (Phase 1) to develop such guidance for mechanically ventilated enclosures. This work was initiated as an international collaborative effort to respond to emerging market needs related to the design and deployment equipment for hydrogen infrastructure that is often installed in individual equipment cabinets or ventilated enclosures. The ultimate objective of this effort is to develop guidance for an optimal sensor placement such that when integrated into a facility design and operation will allow earlier detection at lower levels of incipient leaks leading to significant hazard reduction. Reliable and consistent early warning of hydrogen leaks will allow for the risk mitigation by reducing or even eliminating the probability of escalation of small leaks into large and uncontrolled events. To address this issue a study of a real-world mechanically ventilated enclosure containing GH2 equipment was conducted where CFD modelling of the hydrogen dispersion (performed by AVT and UQTR and independently by the JRC) was validated by the NREL Sensor laboratory using a Hydrogen Wide Area Monitor (HyWAM) consisting of a 10-point gas and temperature measurement analyzer. In the release test helium was used as a hydrogen surrogate. Expansion of indoor releases to other larger facilities (including parking structures vehicle maintenance facilities and potentially tunnels) and incorporation into QRA tools such as HyRAM is planned for Phase 2. It is anticipated that results of this work will be used to inform national and international standards such as NFPA 2 Hydrogen Technologies Code Canadian Hydrogen Installation Code (CHIC) and relevant ISO/TC 197 and CEN documents.

Comparison of Computational Fluid Dynamics (CFD) predictions with measurements is presented for cryo-compressed hydrogen vertical jets. The stagnation conditions of the experiments are characteristic of unintended leaks from pipe systems that connect cryogenic hydrogen storage tanks and could be encountered at a fuel cell refuelling station. Jets with pressure up to 5 bar and temperatures just above the saturation liquid temperature were examined. Comparisons are made to the centerline mass fraction and temperature decay rates the radial profiles of mass fraction and the contours of volume fraction. Two notional nozzle approaches are tested to model the under-expanded jet that was formed in the tests with pressures above 2 bar. In both approaches the mass and momentum balance from the throat to the notional nozzle are solved while the temperature at the notional nozzle was assumed equal to the nozzle temperature in the first approach and was calculated by an energy balance in the second approach. The two approaches gave identical results. Satisfactory agreement with the measurements was found in terms of centerline mass fraction and temperature. However for test with 3 and 4 bar release the concentration was overpredicted. Furthermore a wider radial spread was observed in the predictions possibly revealing higher degree of diffusion using the k-ε turbulence model. An integral model for cryogenic jets was also developed and provided good results. Finally a test simulation was performed with an ambient temperature jet and compared to the cold jet showing that warm jets decay faster than cold jets.

A technoeconomic analysis of photoelectrochemical (PEC) and photovoltaic-electrolytic (PV-E) solar-hydrogen production of 10 000 kg H₂ day⁻¹ (3.65 kilotons per year) was performed to assess the economics of each technology and to provide a basis for comparison between these technologies as well as within the broader energy landscape. Two PEC systems differentiated primarily by the extent of solar concentration (unconcentrated and 10× concentrated) and two PV-E systems differentiated by the degree of grid connectivity (unconnected and grid supplemented) were analyzed. In each case a base-case system that used established designs and materials was compared to prospective systems that might be envisioned and developed in the future with the goal of achieving substantially lower overall system costs. With identical overall plant efficiencies of 9.8% the unconcentrated PEC and non-grid connected PV-E system base-case capital expenses for the rated capacity of 3.65 kilotons H₂ per year were $205 MM ($293 per m² of solar collection area (m_S⁻²) $14.7 W_H2P⁻¹) and $260 MM ($371 mS−2 $18.8 W_H2P⁻¹) respectively. The untaxed plant-gate levelized costs for the hydrogen product (LCH) were $11.4 kg⁻¹ and $12.1 kg⁻¹ for the base-case PEC and PV-E systems respectively. The 10× concentrated PEC base-case system capital cost was $160 MM ($428 m_S−2 $11.5 WH₂P⁻¹) and for an efficiency of 20% the LCH was $9.2 kg−1. Likewise the grid supplemented base-case PV-E system capital cost was $66 MM ($441 _mS⁻² $11.5 W_H2P⁻¹) and with solar-to-hydrogen and grid electrolysis system efficiencies of 9.8% and 61% respectively the LCH was $6.1 kg⁻¹. As a benchmark a proton-exchange membrane (PEM) based grid-connected electrolysis system was analyzed. Assuming a system efficiency of 61% and a grid electricity cost of $0.07 kWh⁻¹ the LCH was $5.5 kg⁻¹. A sensitivity analysis indicated that relative to the base-case increases in the system efficiency could effect the greatest cost reductions for all systems due to the areal dependencies of many of the components. The balance-of-systems (BoS) costs were the largest factor in differentiating the PEC and PV-E systems. No single or combination of technical advancements based on currently demonstrated technology can provide sufficient cost reductions to allow solar hydrogen to directly compete on a levelized cost basis with hydrogen produced from fossil energy. Specifically a cost of CO₂ greater than ∼$800 (ton CO₂)−1 was estimated to be necessary for base-case PEC hydrogen to reach price parity with hydrogen derived from steam reforming of methane priced at $12 GJ⁻¹ ($1.39 (kg H₂)⁻¹). A comparison with low CO₂ and CO₂-neutral energy sources indicated that base-case PEC hydrogen is not currently cost-competitive with electrolysis using electricity supplied by nuclear power or from fossil-fuels in conjunction with carbon capture and storage. Solar electricity production and storage using either batteries or PEC hydrogen technologies are currently an order of magnitude greater in cost than electricity prices with no clear advantage to either battery or hydrogen storage as of yet. Significant advances in PEC technology performance and system cost reductions are necessary to enable cost-effective PEC-derived solar hydrogen for use in scalable grid-storage applications as well as for use as a chemical feedstock precursor to CO₂-neutral high energy-density transportation fuels. Hence such applications are an opportunity for foundational research to contribute to the development of disruptive approaches to solar fuels generation systems that can offer higher performance at much lower cost than is provided by current embodiments of solar fuels generators. Efforts to directly reduce CO₂ photoelectrochemically or electrochemically could potentially produce products with higher value than hydrogen but many as yet unmet challenges include catalytic efficiency and selectivity and CO₂ mass transport rates and feedstock cost. Major breakthroughs are required to obtain viable economic costs for solar hydrogen production but the barriers to achieve cost-competitiveness with existing large-scale thermochemical processes for CO₂ reduction are even greater.

The Hydrogen Incident Reporting and Lessons Learned website (www.h2incidents.org) was launched in 2006 as a database-driven resource for sharing lessons learned from hydrogen-related safety events to raise safety awareness and encourage knowledge-sharing. The development of this database its first uses and subsequent enhancements have been described at the Second and Third International Conferences on Hydrogen Safety [1] [2]. Since 2009 continuing work has not only highlighted the value of safety lessons learned but enhanced how the database provides access to another safety knowledge tool Hydrogen Safety Best Practices (http://h2bestpractices.org). Collaborations with the International Energy Agency (IEA) Hydrogen Implementing Agreement (HIA) Task 19 – Hydrogen Safety and others have enabled the database to capture safety event learning’s from around the world. This paper updates recent progress highlights the new “Lessons Learned Corner” as one means for knowledge-sharing and examines the broader potential for collecting analyzing and using safety event information.

Certification of hydrogen sensors to meet standards often prescribes using large-volume test chambers. However feedback from stakeholders such as sensor manufacturers and end-users indicates that chamber test methods are often viewed as too slow and expensive for routine assessment. Flow-through test methods are potentially an efficient and cost-effective alternative for sensor performance assessment. A large number of sensors can be simultaneously tested in series or in parallel with an appropriate flow-through test fixture. The recent development of sensors with response times of less than 1s mandates improvements in equipment and methodology to properly capture the performance of this new generation of fast sensors; flow methods are a viable approach for accurate response and recovery time determinations but there are potential drawbacks. According to ISO 26142 flow-through test methods may not properly simulate ambient applications. In chamber test methods gas transport to the sensor is dominated by diffusion which is viewed by some users as mimicking deployment in rooms and other confined spaces. Conversely in flow-through methods forced flow transports the gas to the sensing element. The advective flow dynamics may induce changes in the sensor behaviour relative to the quasi-quiescent condition that may prevail in chamber test methods. The aim of the current activity in the JRC and NREL sensor laboratories is to develop a validated flow-through apparatus and methods for hydrogen sensor performance testing. In addition to minimizing the impact on sensor behaviour induced by differences in flow dynamics challenges associated with flow-through methods include the ability to control environmental parameters (humidity pressure and temperature) during the test and changes in the test gas composition induced by chemical reactions with upstream sensors. Guidelines on flow-through test apparatus design and protocols for the evaluation of hydrogen sensor performance have been developed. Various commercial sensor platforms (e.g. thermal conductivity catalytic and metal semiconductor) were used to demonstrate the advantages and issues with the flow-through methodology.

Improving efficiency of hydrogen cooling in cryogenic conditions is important for the wider applications of hydrogen energy systems. The approach investigated in this study is based on a Ranque-Hilsch vortex tube (RHVT) that generates temperature separation in a working fluid. The simplicity of RHVT is also a valuable characteristic for cryogenic systems. In the present work novel shapes of RHVT are computationally investigated with the goal to raise efficiency of the cooling process. Specifically a smooth transition is arranged between a vortex chamber where compressed gas is injected and the main tube with two exit ports at the tube ends. Flow simulations have been carried out using STAR-CCM+ software with the real-gas Redlich-Kwong model for hydrogen at temperatures near 70 K. It is determined that a vortex tube with a smooth transition of moderate size manifests about 7% improvement of the cooling efficiency when compared vortex tubes that use traditional vortex chambers with stepped transitions and a no-chamber setup with direct gas injection.

We investigated hydrogen embrittlement in Fe20Mn20Ni20Cr20Co and Fe30Mn10Cr10Co (at.%) alloys pre-charged with 100 MPa hydrogen gas by tensile testing at three initial strain rates of 10⁻⁴ 10⁻³ and 10⁻² s⁻¹ at ambient temperature. The alloys are classified as stable and metastable austenite-based high-entropy alloys (HEAs) respectively. Both HEAs showed the characteristic hydrogen-induced degradation of tensile ductility. Electron backscatter diffraction analysis indicated that the reduction in ductility by hydrogen pre-charging was associated with localized plasticity-assisted intergranular crack initiation. It should be noted as an important finding that hydrogen-assisted cracking of the metastable HEA occurred not through a brittle mechanism but through localized plastic deformation in both the austenite and ε-martensite phases.

Most experimental investigations of underexpanded hydrogen jets have been limited to circular nozzles in an attempt to better understand the fundamental jet-exit flow physics and model this behaviour with pseudo source models. However realistic compressed storage leak exit geometries are not always expected to be circular. In the present study jet dispersion characteristics from rectangular slot nozzles with aspect ratios from 2 to 8 were investigated and compared with an equivalent circular nozzle. Schlieren imaging was used to observe the jet-exit shock structure while quantitative Planar Laser Rayleigh Scattering was used to measure downstream dispersion characteristics. These results provide physical insight and much needed model validation data for model development.

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.

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.

Liquid hydrogen vent stacks often release hydrogen for example due to pressure relief from an underutilized tank boiling off hydrogen or after hydrogen delivery and transfer (trucks often depressurize through the tank vent stack to meet pressure regulations for on-road transport).<br/>A rapid release of cryogenic hydrogen through a vent stack will condense moisture from the entrained air forming a visible cloud. It is often assumed that the extent of the cold hydrogen is concurrent with the cloud. In this work a laser-based Raman scattering diagnostic was used to map out the hydrogen location during a series of vent stack release experiments. A description of the diagnostic instrument is given followed by a comparison of hydrogen signals to the visible cloud for releases through a liquid hydrogen vent stack. A liquid hydrogen pump was used to vary the flowrate of hydrogen through the vent stack and tests were performed under low and high wind conditions as well as low and high humidity conditions. The hydrogen was observed only where the condensed moisture was located regardless of the humidity level or wind. These measurements are being used to validate models such as those included in Sanda’s HyRAM toolkit and inform safety codes and standards.

Solar-driven hydrogen production from water using particulate photocatalysts is considered the most economical and effective approach to produce hydrogen fuel with little environmental concern. However the efficiency of hydrogen production from water in particulate photocatalysis systems is still low. Here we propose an efficient biphase photocatalytic system composed of integrated photothermal–photocatalytic materials that use charred wood substrates to convert liquid water to water steam simultaneously splitting hydrogen under light illumination without additional energy. The photothermal–photocatalytic system exhibits biphase interfaces of photothermally-generated steam/photocatalyst/hydrogen which significantly reduce the interface barrier and drastically lower the transport resistance of the hydrogen gas by nearly two orders of magnitude. In this work an impressive hydrogen production rate up to 220.74 μmol h−1 cm−2 in the particulate photocatalytic systems has been achieved based on the wood/CoO system demonstrating that the photothermal–photocatalytic biphase system is cost-effective and greatly advantageous for practical applications.

The protonic ceramic electrochemical cell (PCEC) is an emerging and attractive technology that converts energy between power and hydrogen using solid oxide proton conductors at intermediate temperatures. To achieve efficient electrochemical hydrogen and power production with stable operation highly robust and durable electrodes are urgently desired to facilitate water oxidation and oxygen reduction reactions which are the critical steps for both electrolysis and fuel cell operation especially at reduced temperatures. In this study a triple conducting oxide of PrNi0.5Co0.5O3-δ perovskite is developed as an oxygen electrode presenting superior electrochemical performance at 400~600 °C. More importantly the self-sustainable and reversible operation is successfully demonstrated by converting the generated hydrogen in electrolysis mode to electricity without any hydrogen addition. The excellent electrocatalytic activity is attributed to the considerable proton conduction as confirmed by hydrogen permeation experiment remarkable hydration behavior and computations.

The U.S. energy system is evolving as society and technologies change. Renewable electricity generation—especially from wind and solar—is growing rapidly and alternative energy sources are being developed and implemented across the residential commercial transportation and industrial sectors to take advantage of their cost security and health benefits. Systemic changes present numerous challenges to grid resiliency and energy affordability creating a need for synergistic solutions that satisfy multiple applications while yielding system-wide cost and emissions benefits. One such solution is an integrated hydrogen energy system (Figure ES-1). This is the focus of H₂@Scale—a U.S. Department of Energy (DOE) initiative led by the Office of Energy Efficiency and Renewable Energy’s Hydrogen and Fuel Technologies Office. H₂@Scale brings together stakeholders to advance affordable hydrogen production transport storage and utilization in multiple energy sectors. The H₂@Scale concept involves hydrogen as an energy intermediate. Hydrogen can be produced from various conventional and renewable energy sources including as a responsive load on the electric grid. Hydrogen has many current applications and many more potential applications such as energy for transportation—used directly in fuel cell electric vehicles (FCEVs) as a feedstock for synthetic fuels and to upgrade oil and biomass—feedstock for industry (e.g. for ammonia production metals refining and other end uses) heat for industry and buildings and electricity storage. Owing to its flexibility and fungibility a hydrogen intermediate could link energy sources that have surplus availability to markets that require energy or chemical feedstocks benefiting both. This document builds upon a growing body of analyses of hydrogen as an energy intermediate by reporting the results from our initial analysis of the potential impacts of the H₂@Scale vision by the mid-21st century for the 48 contiguous U.S. states. Previous estimates have been based on expert elicitation and focused on hydrogen demands. We build upon them first by estimating hydrogen’s serviceable consumption potential for possible hydrogen applications and the technical potential for producing hydrogen from various resources. We define the serviceable consumption potential as the quantity of hydrogen that would be consumed to serve the portion of the market that could be captured without considering economics (i.e. if the price of hydrogen were $0/kg over an extended period); thus it can be considered an upper bound for the size of the market. We define the technical potential as the resource potential constrained by real-world geography and system performance but not by economics. We then compare the cumulative serviceable consumption potential with the technical potential of a number of possible sources. Second we estimate economic potential: the quantity of hydrogen at an equilibrium price at which suppliers are willing to sell and consumers are willing to buy the same quantity of hydrogen. We believe this method provides a deeper understanding than was available in the previous analyses. We develop economic potentials for multiple scenarios across various market and technology-advancement assumptions.

The location of hydrogen within Ti–Cr–V–Mo alloys has been investigated during hydrogen absorption and desorption using in situ neutron powder diffraction and inelastic neutron scattering. Neutron powder diffraction identifies a low hydrogen equilibration pressure body-centred tetragonal phase that undergoes a martensitic phase transition to a face-centred cubic phase at high hydrogen equilibration pressures. The average location of the hydrogen in each phase has been identified from the neutron powder diffraction data although inelastic neutron scattering combined with density functional theory calculations show that the local structure is more complex than it appears from the average structure. Furthermore the origin of the change in dissociation pressure and hydrogen trapping on cycling in Ti–Cr–V–Mo alloys is discussed.

‟How crack growth is prevented” is key to improve both fatigue and monotonic fracture resistances under an influence of hydrogen. Specifically the key points for the crack growth resistance are hydrogen diffusivity and local ductility. For instance type 304 austenitic steels show high hydrogen embrittlement susceptibility because of the high hydrogen diffusivity of bcc (α´) martensite. In contrast metastability in specific austenitic steels enables fcc (γ) to hcp (ε) martensitic transformation which decreases hydrogen diffusivity and increases strength simultaneously. As a result even if hydrogen-assisted cracking occurs during monotonic tensile deformation the ε-martensite acts to arrest micro-damage evolution when the amount of ε-martensite is limited. Thus the formation of ε-martensite can decrease hydrogen embrittlement susceptibility in austenitic steels. However a considerable amount of ε-martensite is required when we attempt to have drastic improvements of work hardening capability and strength level with respect to transformation-induced plasticity effect. Since the hcp structure contains a less number of slip systems than fcc and bcc the less stress accommodation capacity often causes brittle-like failure when the ε-martensite fraction is large. Therefore ductility of ε-martensite is another key when we maximize the positive effect of ε-martensitic transformation. In fact ε-martensite in a high entropy alloy was recently found to be extraordinary ductile. Consequently the metastable high entropy alloys showed low fatigue crack growth rates in a hydrogen atmosphere compared with conventional metastable austenitic steels with α´-martensitic transformation. We here present effects of metastability to ε-phase and configurational entropy on hydrogen-induced mechanical degradation including monotonic tension properties and fatigue crack growth resistance.

Twinning-induced plasticity (TWIP) steels have higher strength and ductility than conventional steels. Deformation mechanisms producing twins that prevent gliding and stacking of dislocations cause a higher ductility than that of steel grades with the same strength. TWIP steels are considered to be within the new generation of advanced high-strength steels (AHSS). However some aspects such as the corrosion resistance and performance in service of TWIP steel materials need more research. Application of TWIP steels in the automotive industry requires a proper investigation of corrosion behavior and corrosion mechanisms which would indicate the optimum degree of protection and the possible decrease in costs. In general Fe−Mn-based TWIP steel alloys can passivate in oxidizing acid neutral and basic solutions however they cannot passivate in reducing acid or active chloride solutions. TWIP steels have become as a potential material of interest for automotive applications due to their effectiveness impact resistance and negligible harm to the environment. The mechanical and corrosion performance of TWIP steels is subjected to the manufacturing and processing steps like forging and casting elemental composition and thermo-mechanical treatment. Corrosion of TWIP steels caused by both intrinsic and extrinsic factors has posed a serious problem for their use. Passivity breakdown caused by pitting and galvanic corrosion due to phase segregation are widely described and their critical mechanisms examined. Numerous studies have been performed to study corrosion behaviour and passivation of TWIP steel. Despite the large number of articles on corrosion few comprehensive reports have been published on this topic. The current trend for development of corrosion resistance TWIP steel is thoroughly studied and represented showing the key mechanisms and factors influencing corrosion processes and its consequences on TWIP steel. In addition suggestions for future works and gaps in the literature are considered.

The method of Computational Fluid Dynamics is used to predict the process parameters and select the optimum operating regime of a methanol reformer for on-board production of hydrogen as fuel for a 3 kW High-Temperature Proton Exchange Membrane Fuel Cell power system. The analysis uses a three reactions kinetics model for methanol steam reforming water gas shift and methanol decomposition reactions on Cu/ZnO/Al₂O₃ catalyst. Numerical simulations are performed at single channel level for a range of reformer operating temperatures and values of the molar flow rate of methanol per weight of catalyst at the reformer inlet. Two operating regimes of the fuel processor are selected which offer high methanol conversion rate and high hydrogen production while simultaneously result in a small reformer size and a reformate gas composition that can be tolerated by phosphoric acid-doped high temperature membrane electrode assemblies for proton exchange membrane fuel cells. Based on the results of the numerical simulations the reactor is sized and its design is optimized.