Regulating the inner Helmholtz plane structure at the electrolyte-electrode interface for highly reversible aqueous Zn batteries

The development of aqueous Zn batteries is limited by parasitic water reactions,corrosion,and dendrite growth.To address these challenges,an inner Helmholtz plane(IHP)regulation method is proposed by employing low-cost,non-toxic maltitol as the electrolyte additive.The preferential adsorption behavior of maltitol can expel the water from the inner Helmholtz plane,and thus hinder the immediate contact between Zn metal and H_(2)O.Meanwhile,strong interaction between maltitol and H_(2)O molecules can restrain the activity of H_(2)O.Besides,the"IHP adsorption effect"along with the low LUMO energy level of maltitol-CF_(3)SO_(3)^(-)can promote the in-situ formation of an organic-inorganic complex solid electrolyte interface(SEI)layer.As a result,the hydrogen/oxygen evolution side reaction,corrosion,and dendrites issues are effectively suppressed,thereby leading to highly reversible and dendrite-free Zn plating/stripping.The Zn‖I_(2)battery with hybrid electrolytes also demonstrates high electrochemical performance and ultralong cycling stability,showing a capacity retention of 75%over 20000 charge-discharge cycles at a large current density of 5 A g^(-1).In addition,the capacity of the device has almost no obvious decay over20000 cycles even at-30℃.This work offers a successful electrolyte regulation strategy via the IHP adsorption effect to design electrolytes for high-performance rechargeable Zn-ion batteries.

Gas-sensor property of single-molecule device:F_2 adsorbing effect

The single thiolated arylethynylene molecule with 9,10-dihydroanthracene core（denoted as TADHA） possesses pronounced negative differential conductance（NDC） behavior at lower bias regime. The adsorption effects of F2 molecule on the current and NDC behavior of TADHA molecular junctions are studied by applying non-equilibrium Green＇s formalism combined with density functional theory. The numerical results show that the F2 molecule adsorbed on the benzene ring of TADHA molecule near the electrode can dramatically suppresses the current of TADHA molecular junction. When the F2 molecule adsorbed on the conjugated segment of 9,10-dihydroanthracene core of TADHA molecule, an obviously asymmetric effect on the current curves induces the molecular system showing apparent rectifier behavior. However, the current especially the NDC behavior have been significantly enlarged when F2 addition reacted with triple bond of TADHA molecule.

OPTICAL EFFECTS OF ANION ADSORPTION ON SILVER SOL

The optical effects of anion adsorption on silver sol have been studied, It was found that the anion adsorption can make the absorption peak of pure silver sol shifting to longer vevelenngth, which is attributed to the reduction of the free electron density in the surface layer of the silver particle.

Effect of Mixed Oxide Support for Ni/ZnO in Reactive Adsorption Desulfurization

The effect of mixed oxide support on the performance of Ni/ZnO in the reactive adsorption desulfurization(RADS) reaction was investigated in a fixed bed reactor by using thiophene as the sulfur-containing compound in the model gasoline. A series of oxide supports for Ni/ZnO were synthesized by the co-precipitation method and characterized by XRD, N_2-adsorption, TPR and NH_3-TPD techniques. It was found that the desulfurization capacity of Ni/ZnO was enhanced greatly when active components were supported on the proper mixed oxide. Ni/ZnO supported on oxides exhibited much higher desulfurization efficiency and sulfur adsorption capacity than the unsupported Ni/ZnO and the synthesized Ni/ZnO-SA adsorbent exhibited the highest efficiency for thiophene removal. The higher desulfurization activity and sulfur capacity of Ni/ZnO supported on SiO_2-Al_2O_3 with small particle size, high specific surface area and large pore volume could promote the high dispersion of active metal phase and the transfer of sulfur to ZnO with lower mass transfer resistance. γ-Al_2O_3 species could weaken the interaction of active phases and SiO_2 as well as could increase greatly the amount of weak acids. Therefore, these oxides could impose a great influence on the structure and chemical properties of the catalyst.

Molecular Dynamics Simulation on Stability of Insulin on Graphene

The adsorption dynamics of a model protein （the human insulin） onto graphene surfaces with different sizes was investigated by molecular dynamics simulations. During the adsorption, it has different effect on the stability of the model protein in the fixed and non-fixed graphene systems. The tertiary structure of the protein was destroyed or partially destroyed, and graphene surfaces shows the selective protection for some α-helices in non-fixed Systems but not in fixed systems by reason of the flexibility of graphene. As indicated by the interaction energy curve and trajectory animation, the conformation and orientation selection of the protein were induced by the properties and the texture of graphene surfaces. The knowledge of protein adsorption on graphene surfaces would be helpful to better understand stability of protein on graphene surfaces and facilitate potential applications of graphene in biotechnology.

Deformation transition of intact coal induced by gas injection

Gas migration in coal bed is a multiple-physical process, of which not only includes gas desorption/diffusion through coal matrix and gas Darcy flow through the cleat system, but also results in deformation of solid coal. Especially for enhanced coal bed methane(ECBM) and CO2 capture and sequestration(CCS), gas injection is mainly controlled by the gas diffusivity in the coal matrix and coal permeability.Although the relevant coal permeability models have been frequently developed, how the dual-porosity system of coal affects gas adsorption/diffusion is still poorly understood. In this paper, a series of experiments were carried out in order to investigate deformation evolution of intact coal subjected to hydrostatic pressure of different gases(including pure H2, N2 and CO2) under isotherm injection. In the testing process, the coal strain and injected gas pressure were measured simultaneously. The results show that the pressure of non-adsorptive helium remained unchanged throughout the isothermal injection process, in which the volumetric strain of the coal shrinked firstly and maintained unchanged at lower isobaric pressure. With the injected pressure increasing, the coal volume underwent a transition from shrinking to recovery(still less than initial volume of the coal). In contrast, N2 injection caused the coal to shrink firstly and then recover with decreasing gas pressure. The recovery volume was larger than the initial volume due to adsorption-induced swelling. For the case of CO2 injection, although the stronger adsorption effect could result in swelling of the solid coal, the presence of higher gas pressure appears to contribute the swelling coal to shrink. These results indicate that the evolution of coal deformation is time dependent throughout the migration of injected gas. From the mechanical characteristics of poroelastical materials, distribution of pore pressure within the coal is to vary with the gas injection,during which the pore pressure in the cleats will rapidly increase, in contrast, the pore pressure in the matrix will hysteretically elevate. Such a difference on changes of pore pressure between the cleats and the matrix will contribute to the shrinkage of the matrix as a result of initially greater effective stress.Besides, both gas-adsorption-induced swelling and decreasing effective stress also control the coal deformation transition. This work gives us an insight into investigation on influence of effective stress on coal-gas interaction.

SEGMENT DENSITY PROFILES OF COMPACT POLYMER CHAINS CONFINED BETWEEN TWO PARALLEL PLANE WALLS

We use the pruned-enriched Rosenbluth method to investigate systematically the segment density profiles of compact polymer chains confined between two parallel plane walls. The non-adsorption case of adsorption interaction energy ε = 0 and the weak adsorption case of ε= -1 are considered for the compact polymer chains with different chain lengths N and different separation distances between two walls D. Several special entropy effects on the confined compact polymer chains, such as a damped oscillation in the segment density profile for the large separation distance D, are observed and discussed for different separation distances D in the non-adsorption case. In the weak adsorption case, investigations on the segment density profiles indicate that the competition between the entropy and adsorption effects results in an obvious depletion layer. Moreover, the scaling laws of the damped oscillation period Td and the depletion layer width Ld are obtained for the confined compact chains. Most of these results are obtained for the first time so far as we know, which are expected to understand the properties of the confined compact polymer chains more completely.

Geomechanical risk and mechanism analysis of CO_(2) sequestration in unconventional coal seams and shale gas reservoirs

With global greenhouse gas emissions hitting record highs in 2021,CO_(2) geological sequestration(CGS)is the most realistic and feasible technology to ensure large-scale carbon reduction to achieve global carbon capping and carbon neutrality goals.Both coalbed methane and shale gas have the characteristics of self-generation and selfstorage,which is considered to be a valuable target reservoir for geological sequestration of CO_(2).After a high volume of CO_(2) is injected into unconventional coal seams and shale gas reservoirs,many geomechanical issues may be induced,resulting in leakage.Therefore,it is crucial to evaluate the geomechanical risks of CO_(2) geological sequestration.In this article,global CO_(2) emissions and geological resources available for sequestration are teased out.The effects of coupled CO_(2)-water-rock-driven geomechanical,geophysical,and geochemical interactions on the evolution of rock physical properties and pore characteristics,as well as caprock sealing,are discussed.The caprock failure and its inducing mechanism are analyzed,and the criteria for predicting the occurrence of risk are summarized,which is necessary for pressure management and risk prevention.To serve as a benchmark for CO_(2) sequestration in unconventional coal seams and shale gas reservoirs.

Adsorption of phosphorus in sediment re-suspension under sudden expansion flow conditions

Based on the study of hydraulic characteristics of the sudden expansion water flow of an annular flume, this paper determines the vertical velocity distribution and the turbulence intensity distribution in the mainstream and the recirculation regions to analyze the basic features of this flow field. The adsorption of the phosphorus in the sediment is studied by adding the bacteriostatic agent. The results show that the flow speed in the mainstream region is higher than that in the recirculation region. However, the turbulence intensity in the recirculation region increases more than that in the mainstream region. The adsorption of the phosphorus in the sediment includes the physisorption and the biosorption, and the former is stronger than the latter. With the biosorption in the phosphorus removal process, the phosphorus released by the sediment is mainly completed by the poly-P bacteria in the anaerobic condition. The adsorption of the phosphorus in the sediment in the mainstream region of a sudden expansion water flow is strong and stable, whereas the adsorption in the sediment in the recirculation region is largely fluctuated.