China, People’s Republic

A new criterion for hydrogen-induced cracking (HIC) that includes both the embrittlement effect and the loading effect of hydrogen was obtained theoretically. The surface cohesive energy and plastic deformation energy are reduced by hydrogen atoms at the interface; thus the fracture toughness is reduced according to fracture mechanics theory. Both the pressure effect and the embrittlement effect mitigate the critical condition required for crack instability extension. During the crack instability expansion the hydrogen in the material can be divided into two categories: hydrogen atoms surrounding the crack and hydrogen molecules in the crack cavity. The loading effect of hydrogen was verified by experiments and the characterization methods for the stress intensity factor under hydrogen pressure in a linear elastic model and an elastoplastic model were analyzed using the finite-element simulation method. The hydrogen pressure due to the aggregation of hydrogen molecules inside the crack cavity regularly contributed to the stress intensity factor. The embrittlement of hydrogen was verified by electrolytic charging hydrogen experiments. According to the change in the atomic distribution during crack propagation in a molecular dynamics simulation the transition from ductile to brittle fracture and the reduction in the fracture toughness were due to the formation of crack tip dislocation regions suppressed by hydrogen. The HIC formation mechanism is both the driving force of crack propagation due to the hydrogen gas pressure and the resisting force reduced by hydrogen atoms.

Solid oxide fuel cells (SOFCs) produce electricity with high electrical efficiency and fuel flexibility without pollution for example CO₂ NO_x SO_x and particles. Still numerous issues hindered the large‐scale commercialization of fuel cell at a large scale such as fuel storage mechanical failure catalytic degradation electrode poisoning from fuel and air for example lifetime in relation to cost. Computational fluid dynamics (CFD) couples various physical fields which is vital to reduce the redundant workload required for SOFC development. Modeling of SOFCs includes the coupling of charge transfer electrochemical reactions fluid flow energy transport and species transport. The Butler‐Volmer equation is frequently used to describe the coupling of electrochemical reactions with current density. The most frequently used is the activation‐ and diffusion‐controlled Butler‐Volmer equation. Three different electrode reaction models are examined in the study which is named case 1 case 2 and case 3 respectively. Case 1 is activation controlled while cases 2 and 3 are diffusion‐controlled which take the concentration of redox species into account. It is shown that case 1 gives the highest reaction rate followed by case 2 and case 3. Case 3 gives the lowest reaction rate and thus has a much lower current density and temperature. The change of activation overpotential does not follow the change of current density and temperature at the interface of the anode and electrolyte and interface of cathode and electrolyte which demonstrates the non‐linearity of the model. This study provides a reference to build electrochemical models of SOFCs and gives a deep understanding of the involved electrochemistry.

Understanding the mechanism of hydrogen embrittlement (HE) of austenitic steels and developing an effective strategy to improve resistance to HE are of great concern but challenging. In this work first-principles studies were performed to investigate the HE mechanism and the improved resistance of Al-containing austenite to HE. Our results demonstrate that interstitial hydrogen atoms have different site preferences in Al-free and Al-containing austenites. The calculated binding energies and diffusion barriers of interstitial hydrogen atoms in Al-containing austenite are remarkably higher than those in Al-free austenite indicating that the presence of Al is more favorable for reducing hydrogen mobility. In Al-free austenite interstitial hydrogen atoms caused a remarkable increase in lattice compressive stress and a distinct decrease in bulk shear and Young’s moduli. Whereas in Al-containing austenite the lattice compressive stress and the mechanical deterioration induced by interstitial hydrogen atoms were effectively suppressed.

Study of flame acceleration and deflagration-to-detonation transition (DDT) in obstructed channels is an important subject of research for hydrogen safety. Experiments and numerical simulations of DDT in channels equipped with triangular obstacles were conducted in this work. High-speed schlieren photography and pressure records were used to study the flame shape changes flame propagation and pressure build up in the experiments. In the simulations the fully compressible reactive Navier–Stokes equations coupled with a calibrated chemical-diffusion model for stoichiometric hydrogen-oxygen mixture were solved using a high-order numerical method. The simulations were in good agreement with the experiments. The results show that the triangular obstacles significantly promote the flame acceleration and provide conditions for the occurrence of DDT. In the early stages of flame acceleration vortices are generated in the gaps between adjacent obstacles which is the main cause for the flame roll-up and distortion. A positive feedback mechanism between the combustiongenerated flow and flame propagation results in the variations of the size and velocity of vortices. The flame-vortex interactions cause flame fragmentation and consequently rapid growth in flame surface area which further lead to flame acceleration. The initially laminar flame then develops into a turbulent flame with the creation of shocks shock-flame interactions and various flame instabilities. The continuously arranged obstacles interact with shocks and flames and help to create environments in which a detonation can develop. Both flame collision and flame-shock interaction can give rise to detonation in the channels with triangular obstacles.

Fracture failure caused by hydrogen embrittlement (HE) is a major concern for the system reliability and safety of hydrogen storage vessels which are generally made of 2.25Cr1Mo0.25V steel. Thus study of the influence of pre-charged hydrogen on fracture toughness of as-received 2.25Cr1Mo0.25V steel and weld is of significant importance. In the current work the influence of hydrogen on fracture toughness of as-received 2.25Cr1Mo0.25V steel and weld was systematically studied. Base metal (BM) and weld metal (WM) specimens under both hydrogen-free and hydrogen-charged conditions were tested using three-point bending tests. Hydrogen was pre-charged inside specimens by the immersion charging method. The J-integral values were calculated for quantitatively evaluating the fracture toughness. In order to investigate the HE mechanisms optical microscopy (OM) and scanning electron microscopy (SEM) were used to characterize the microstructure of BM and WM specimens. The results revealed that the presence of pre-charged hydrogen caused a significant decrease of the fracture toughness for both BM and WM specimens. Moreover the pre-charged hydrogen led to a remarkable transition of fracture mode from ductile to brittle pattern in 2.25Cr1Mo0.25V steel.

In this study electrochemical measurements immersion tests and slow strain rate tensile (SSRT) tests were applied to investigate the electrochemical and stress corrosion cracking (SCC) behavior of X70 steel in simulated seawater with the interference of different alternating current (AC) densities. The results indicate that AC significantly strengthens the cathodic reaction especially the oxygen reduction reaction. Simultaneously hydrogen evolution reaction occurs when the limiting diffusion current density of oxygen reaches and thus icorr sharply increases with the increase in AC density. Additionally when AC is imposed the X70 steel exhibits higher SCC susceptibility in the simulated seawater and the susceptibility increases with the increasing AC density. The SCC mechanism is controlled by both anodic dissolution (AD) and hydrogen embrittlement (HE) with the interference of AC.

Hydrogen separation through oxygen transport membranes (OTMs) has attracted much attention. Asymmetric membranes with thin dense layers provide low bulk diffusion resistances and high overall hydrogen separation performances. However the resistance in the porous support layer (PSL) limits the overall separation performance significantly. Engineering the structure of the PSL is an appropriate way to enable fast gas transport and increase the separation performance. There is no relevant research on studying the influence of the PSL on hydrogen separation performance so far. Herein we prepared Ce_0.85Sm_0.15O_1.925 – Sm_0.6Sr_0.4Cr_0.3Fe_0.7O_3-δ (SDC-SSCF) asymmetric membranes with straight grooves in PSL by tape-casting and laser grooving. A ~30% improvement in the hydrogen separation rate was achieved by grooving in the PSLs. It indicates that the grooves may reduce the concentration polarization resistance in PSL for the hydrogen separation process. This work provides a straight evidence on optimizing the structures of PSL for improving the hydrogen separation performance of the membrane reactors.

The reversible/irreversible recovery of mechanical properties and the microstructure characteristics of a typical hot-stamped steel B1500HS have been studied under different conditions of hydrogen permeation. Initially all tested specimens were permeated by hydrogen atoms through an electrochemical hydrogen charging scheme. Then the comparisons between different currents and charging time were performed. The influence of different storage time was compared as well. Additionally the effect of the plastic strain introduced by pre-stretching was also investigated. The experimental results showed that the negative impact of hydrogen embrittlement was altered from reversible to irreversible as the magnitude of the charging current increased. The hydrogen blistering and the hydrogen charging-induced cracks were both observed and inspected in the tested samples regarding the irreversible situation. Moreover the adverse influence of hydrogen embrittlement was enhanced by plastic pre-straining or extending the charging period. At the micro-level hydrogen charging-induced cracks generally were generated at defect locations such as the prior austenite grain boundaries and lath martensite interfaces. Particularly crack direction occurred perpendicular to the orientation of lath martensite and transgranular fracture occurred at the prior austenite grains.

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.

In the current study the effect of hydrogen atoms on the intergranular failure of α-iron is examined by a molecular dynamics (MD) simulation. The effect of hydrogen embrittlement on the grain boundary (GB) is investigated by diffusing hydrogen atoms into the grain boundaries using a bicrystal body-centered cubic (BCC) model and then deforming the model with a uniaxial tension. The Debye Waller factors are applied to illustrate the volume change of GBs and the simulation results suggest that the trapped hydrogen atoms in GBs can therefore increase the excess volume of GBs thus enhancing intergranular failure. When a constant displacement loading is applied to the bicrystal model the increased strain energy can barely be released via dislocation emission when H is present. The hydrogen pinning effect occurs in the current dislocation slip system <111>{112}. The hydrogen atoms facilitate cracking via a decrease of the free surface energy and enhance the phase transition via an increase in the local pressure. Hence the failure mechanism is prone to intergranular failure so as to release excessive pressure and energy near GBs. This study provides a mechanistic framework of intergranular failure and a theoretical model is then developed to predict the intergranular cracking rate