Microscopic growth mechanism and edge states of monolayer 1T'-MoTe_(2)

Transition metal ditellurides(TMTDs)have versatile physical properties,including non-trivial topology,Weyl semimetal states and unique spin texture.Controlled growth of high-quality and large-scale monolayer TMTDs with preferred crystal phases is crucial for their applications.Here,we demonstrate the epitaxial growth of 1T'-MoTe_(2) on Au(111)and graphitized silicon carbide(Gr/SiC)by molecular beam epitaxy(MBE).We investigate the morphology of the grown1T'-MoTe_(2) at the atomic level by scanning tunnelling microscopy(STM)and reveal the corresponding microscopic growth mechanism.It is found that the unique ordered Te structures preferentially deposited on Au(111)regulate the growth of monolayer single crystal 1T'-MoTe_(2),while the Mo clusters were preferentially deposited on the Gr/SiC substrate,which impedes the ordered growth of monolayer MoTe_(2).We confirm that the size of single crystal 1T'-MoTe_(2) grown on Au(111)is nearly two orders of magnitude larger than that on Gr/SiC.By scanning tunnelling spectroscopy(STS),we observe that the STS spectrum of the monolayer 1T'-MoTe_(2) nano-island at the edge is different from that at the interior,which exhibits enhanced conductivity.

Studies on the Microscopic Mechanism of the Thermodynamic Stability of Pesticide Microemulsion

The cryo-fracture electron microscope was used to study the micro-structure of pesticide mi-croemulsions. The hydromechanical radius (Rh) and the distribution (fRh) of pesticide microemulsions were determined by photo-correlation spectroscopy. This study showed that the Rh was significantly greater when the ratio of surfactants to water (w/w) decreased to 20/31 from 27/26, and a bicontinuous structure was formed when the ratio dropped to 15/36. These results explained the relationship between pesticide properties and the microscopic structure, and provided a good method for studying the microscopic structure of pesticide formulations.

Mechanical response and microscopic damage mechanism of pre-flawed sandstone subjected to monotonic and multilevel cyclic loading:A laboratory-scale investigation

This study aims to investigate the mechanical response and acoustic emission(AE)characteristic of pre-flawed sandstone under both monotonic and multilevel constant-amplitude cyclic loads.Specifically,we explored how coplanar flaw angle and load type impact the strength and deformation behavior and microscopic damage mechanism.Results indicated that being fluctuated before rising with increasing fissure angle under monotonic loading,the peak strength of the specimen first increased slowly and then steeply under cyclic loading.The effect of multilevel cyclic loading on the mechanical parameters was more significant.For a single fatigue stage,the specimen underwent greater deformation in early cycles,which subsequently stabilized.Similar variation pattern was also reflected by AE count/energy/b-value.Crack behaviors were dominated by the fissure angle and load type and medium-scale crack accounted for 74.83%–86.44%of total crack.Compared with monotonic loading,crack distribution of specimen under cyclic loading was more complicated.Meanwhile,a simple model was proposed to describe the damage evolution of sandstone under cyclic loading.Finally,SEM images revealed that the microstructures at the fracture were mainly composed of intergranular fracture,and percentage of transgranular fracture jumped under cyclic loading due to the rapid release of elastic energy caused by high loading rate.

Microscopic mechanism of perfluorocarbon gas formation in aluminum electrolysis process

In view of the unclear cause of perfluorocarbons(PFCs)emission in the anode effect stage of aluminum electrolysis,the microscopic formation mechanism of PFCs was studied by density functional theory calculation and X-ray photoelectron spectroscopy(XPS).It is found that the discharge of fluorine containing anions([F]−)on carbon anode first causes the substitution of C—H by C—F and further results in the saturation of aromatic C—C bonds,leading to the appearance of—CF_(3)or—C_(2)F_(5)group through six-carbon-ring opening.Elimination of—CF_(3)and—C_(2)F_(5) with F atom could be a likely mechanism of CF_(4) and C_(2)F_(6) formation.XPS results confirm that different types of—CF_(x) group can be formed on anode surface during electrolysis,and the possibility that[F]−discharges continuously at the C edge and finally forms different C—F bonds in quantum mechanical calculation was verified.

Microscopic mechanism of periodical electroosmosis in reservoir rocks

Based on the electric double layer （EDL） theory and the momentum equation governing the electroosmosis flow, this paper presents an analytical solution to the peri- odical electroosmosis with a parallel straight capillary bundle model of reservoir rocks to reveal the microscopic mechanism of the electroosmotic flows in rocks. The theory shows that both the frequency dispersion characteristics of the ma^roscQpic electroosmotic Darcy velocity in unsealed rocks and the electroosmotic pressure coefficient in sealed rocks de- pend on the porosity and electrochemical properties of reservoir rocks. The mathematical simulation indicates that the distribution of the periodical electroosmotic velocity is wave- like in the rock pore. The greater the porosity is, the greater electroosmotic the Darcy velocity and the smaller electroosmotic pressure coefficient are generated. The module values of the electroosmotic Darcy velocity and the electroosmotic pressure coefficient increase with the decreasing solution concentration or the increasing cation exchange ca- pacity without affecting the phase of the electroosmotic Darcy velocity.

Stress sensitivity of carbonate gas reservoirs and its microscopic mechanism

In order to evaluate the stress sensitivity of carbonate reservoirs,a series of rock stress sensitivity tests were carried out under in-situ formation temperature and stress condition.Based on the calibration of capillary pressure curve,the variable fractal dimension was introduced to establish the conversion formula between relaxation time and pore size.By using the nuclear magnetic resonance(NMR)method,the pore volume loss caused by stress sensitivity within different scales of pore throat was quantitatively analyzed,and the microscopic mechanism of stress sensitivity of carbonate gas reservoirs was clarified.The results show that fractures can significantly affect the stress sensitivity of carbonate reservoirs.With the increase of initial permeability,the stress sensitivity coefficient decreases and then increases for porous reservoirs,but increases monotonously for fractured-porous reservoirs.The pore volume loss caused by stress sensitivity mainly occurs for mesopores(0.02–0.50μm),contributing more than 50%of the total volume loss.Single high-angle fracture contributes 9.6%of the stress sensitivity and 15.7%of the irreversible damage.The microscopic mechanism of the stress sensitivity of carbonate gas reservoirs can be concluded as fracture closure,elastic contraction of pores and plastic deformation of rock skeleton.

Experimental characterization and mechanism of hydraulic pulsation waves driving microscopic residual oil

To clarify microscopic mechanisms of residual oil displacement by hydraulic pulsation wave,microscopic visualization experiments of hydraulic pulsation wave driving residual oil were carried out by using the microscopic visualization device of pulsating water drive.For the four types of residual oil left in the reservoir after water flooding,i.e.membrane,column,cluster,and blind end residual oils,hydraulic pulsation waves broke the micro-equilibrium of the interface by disturbing the oil-water interface,so that the injected water invaded into and contacted with the remaining oil in small pores and blind holes,and the remaining oil was pushed or stripped to the mainstream channel by deformation superposition effect and then carried out by the injected water.In the displacement,the pulsation frequency mainly affected the cluster and blind end remaining oil,and the hydraulic pulsation wave with a frequency of about 1 Hz had the best effect in improving the recovery.The pulsation amplitude value mainly affected the membrane and column residual oil,and the larger the amplitude value,the more remaining oil the hydraulic pulsation wave would displace.The presence of low intensity continuous flow pressure and holding pressure end pressure promoted the concentration of pulsating energy and greatly improve the recovery of cluster residual oil.The rise in temperature made the hydraulic pulsation wave work better in displacing remaining oil,improving the efficiency of oil flooding.

The microscopic mechanical performance for nonuniform welded joint of nickel-based alloy with nanoindentation

To quantify the nonuniform micromechanical performance of welded joint,the load-displacement curves by nanoindentation test were introduced to examine different zones including base metal,coarse grained heat affected zone,partially melted zone,weld metal near the fusion boundary and weld metal center.The results showed that the strengthening effect of weld metal was more obvious than that of heat affected zone for nickel based welded joint and especially in coarse grained heat affected zone,the hardening resulted from overheating was not apparent.Nickel based weld metal with high content of alloying elements which were often segregated at interdendritic regions or precipitated in grain interior under nonequilibrium solidification contributed to the characteristics that differ from conventional low alloy steel welded joint.

Single-factor analysis and interaction terms on the mechanical and microscopic properties of cemented aeolian sand backfill

The use of aeolian sand(AS)as an aggregate to prepare coal mine cemented filling materials can resolve the problems of gangue shortage and excessive AS deposits.Owing to the lack of research on the mechanism of cemented AS backfill(CASB),the response surface method(RSM)was adopted in this study to analyze the influence of ordinary Portland cement(PO)content(x_(1)),fly ash(FA)-AS(FA-AS)ratio(x_(2)),and concentration(x_(3))on the mechanical and microscopic properties of the CASB.The hydration characteristics and internal pore structure of the backfill were assessed through thermogravimetric/derivative thermogravimetric analysis,mercury intrusion porosimetry,and scanning electron microscopy.The RSM results show that the influence of each factor and interaction term on the response values is extremely significant(except x_(1)x_(3),which had no obvious effect on the 28 d strength).The uniaxial compressive strength(UCS)increased with the PO content,FA-AS ratio,and concentration.The interaction effects of x_(1)x_(2),x_(1)x_(3),and x_(2)x_(3) on the UCS at 3,7,and 28 d were analyzed.In terms of the influence of interaction items,an improvement in one factor promoted the strengthening effect of another factor.The enhancement mechanism of the curing time,PO content,and FA-AS ratio on the backfill was reflected in the increase in hydration products and pore structure optimization.By contrast,the enhancement mechanism of the concentration was mainly the pore structure optimization.The UCS was positively correlated with weight loss and micropore content but negatively correlated with the total porosity.The R^(2) value of the fitting function of the strength and weight loss,micropore content,and total porosity exceeded 0.9,which improved the characterization of the enhancement mechanism of the UCS based on the thermogravimetric analysis and pore structure.This work obtained that the influence rules and mechanisms of the PO,FA-AS,concentration,and interaction terms on the mechanical properties of the CASB provided a certain theoretical and engineering guidance for CASB filling.

The wave-corpuscle properties of microscopic particlesin the nonlinear quantum-mechanical systems

We debate first the properties of quantum mechanics and its difficulties and the reasons resulting in these diffuculties and its direction of development. The fundamental principles of nonlinear quantum mechanics are proposed and established based on these shortcomings of quantum mechanics and real motions and interactions of microscopic particles and backgound field in physical systems. Subsequently, the motion laws and wave-corpuscle duality of microscopic particles described by nonlinear Schr?dinger equation are studied completely in detail using these elementary principles and theories. Concretely speaking, we investigate the wave-particle duality of the solution of the nonlinear Schr?dinger equation, the mechanism and rules of particle collision and the uncertainty relation of particle’s momentum and position, and so on. We obtained that the microscopic particles obey the classical rules of collision of motion and satisfy the minimum uncertainty relation of position and momentum, etc. From these studies we see clearly that the moved rules and features of microscopic particle in nonlinear quantum mechanics is different from those in linear quantum mechanics. Therefore, nolinear quantum mechanics is a necessary result of development of quantum mechanics and represents correctly the properties of microscopic particles in nonlinear systems, which can solve difficulties and problems disputed for about a century by scientists in linear quantum mechanics field.

MECHANISM OF MICROBAND FORMATION IN COLD ROLLED INTERSTITIAL-FREE STEEL

The mechanism of the shear band formation in the high cold rolled BCC metal is analyzed. Based on the plastic deformation theory, the shear distribution in the deformed grain is calculated by using the Taylor constraint model and the Bishop ＆ Hill maximum work principle. Results show that when the rolling direction （RD） is parallel to a certain direction of a grain, the large localized shear occurs on one slip plane, thus generating microbands in the grain because of the high localized shear strain. The angle between the RD and the shear band is about 30°. The plate-like structure of the microband is formed because of the dislocation double cross slip. The transmission electron microscope （TEM） observation of the microband in the cold rolled BCC metal confirms the formation mechanism of the microband.

A Microscopic and Nanoscale Understanding of the Formation of Gold Geochemical Provinces

Gold geochemical provinces in China were delineated through stream sediment or catchment sediment sampling in this study.Each gold geochemical province delineated by a threshold value of 2.5 ng/g covers an area of thousands of kilometers.It is a dilemma that geochemists traditionally thought that gold could not migrate for a long distance in rivers or streams to form a large-scale geochemical anomaly due to its chemical inertness and high specific density.The quantitative spectroscopic analysis and observations under a scanning electron microscope （SEM） indicate the presence of submicroscopic gold particles （〈5 μm in diameter） in large quantities,and observations under a Transmission Electron Microscopy （TEM） further suggest the presence of nanoscale gold particles （several tens of nanometre in diameter） in ores,rocks,soils and stream sediments.Particularly,submicroscopic and nanoscale gold particles less than 5 μm were only found in samples having a low gold content （〈10ng/g）.This result shows that geochemical provinces,delineated by a threshold value of 2.5 ng/g,are formed by long-distance transport of ultrafine gold in streams.The findings may provide direct microscopic evidence for gold migration to form geochemical provinces.

Evaluation on Self-healing Mechanism and Hydrophobic Performance of Asphalt Modified by Siloxane and Polyurethane

In order to inhibit and remove the thin ice and extend the lifetime of the damaged bridge, the self-healing mechanism and hydrophobic performance of asphalt modified by siloxane and polyurethane (ASP) were studied by dynamic shear rheology (DSR), fluorescence microscope (FM), atomic force microscope (AFM), the fracture-healing-re-fracture test and molecular simulations. The experimental results indicated that the selfhealing capability of ASP increased with increasing heating time and temperature. Furthermore, the addition of siloxane could improve the reaction energy barrier and complex modulus, and it is believed that the self-healing is a viscosity driven process, consisting of two parts namely crack closure and properties recovery. Contact angle of ASP increased with the increasing siloxane content and it deduced that the siloxane could improve the hydrophobic performance of ASP and the ASP molecule model could simulate well the self-healing mechanism and hydrophobic performance of ASP.

Mechanism investigation on coal and gas outburst: An overview

Coal and gas outburst is a frequent dynamic disaster during underground coal mining activities.After about 150 years of exploration,the mechanisms of outbursts remain unclear to date.Studies on outburst mechanisms worldwide focused on the physicochemical and mechanical properties of outburst-prone coal,laboratory-scale outburst experiments and numerical modeling,mine-site investigations,and doctrines of outburst mechanisms.Outburst mechanisms are divided into two categories:single-factor and multi-factor mechanisms.The multi-factor mechanism is widely accepted,but all statistical phenomena during a single outburst cannot be explained using present knowledge.Additional topics about outburst mechanisms are proposed by summarizing the phenomena that need precise explanation.The most appealing research is the microscopic process of the interaction between coal and gas.Modern physical-chemical methods can help characterize the natural properties of outburst-prone coal.Outburst experiments can compensate for the deficiency of first-hand observation at the scene.Restoring the original outburst scene by constructing a geomechanical model or numerical model and reproducing the entire outburst process based on mining environment conditions,including stratigraphic distribution,gas occurrence,and geological structure,are important.Future studies can explore outburst mechanisms at the microscale.

Strength weakening and its micromechanism in water–rock interaction,a short review in laboratory tests

Water–rock interaction(WRI)is a topic of interest in geology and geotechnical engineering.Many geological hazards and engineering safety problems are severe under the WRI.This study focuses on the water weakening of rock strength and its infuencing factors(water content,immersion time,and wetting–drying cycles).The strength of the rock mass decreases to varying degrees with water content,immersion time,and wetting–drying cycles depending on the rock mass type and mineral composition.The corresponding acoustic emission count and intensity and infrared radiation intensity also weaken accordingly.WRI enhances the plasticity of rock mass and reduces its brittleness.Various microscopic methods for studying the pore characterization and weakening mechanism of the WRI were compared and analyzed.Various methods should be adopted to study the pore evolution of WRI comprehensively.Microscopic methods are used to study the weakening mechanism of WRI.In future work,the mechanical parameters of rocks weakened under long-term water immersion(over years)should be considered,and more attention should be paid to how the laboratory scale is applied to the engineering scale.

Rheo-optic in situ synchronous study on the gelation behaviour and mechanism of waxy crude oil emulsions

An improved rheo-optic in situ synchronous measurement system was employed to investigate the gelation behaviour and mechanism of waxy crude oil emulsions. By combining transmitted natural light and reflected polarized light microscopy, a multiangle composite light source was built to achieve the simultaneous observation of wax crystals and emulsified water droplets, as well as their dynamic aggregation process. Main outcomes on the microscopic mechanism were obtained by developed microscopic image processing method. It was found that the microstructure of W/O waxy crude oil emulsion has the evolution of “individual structure--homogeneous aggregate structure--heterogeneous coaggregate structure--floc structure” during the static cooling, which results in the four stages during gelation process. Different from previous studies, the aggregation of emulsified water droplets was found to be more significant and contributes to the formation and development of the wax crystals-emulsified water droplets coaggregate, which plays a decisive role in the further evolution of the gelled microstructure. Time series microscopic images show the dynamic aggregation of emulsified water droplets and wax crystals. Two different aggregation behaviours between wax crystals and water droplets were observed. That wax crystals can not only embed in gaps between adjacent water droplets and enhance the structure, but also surround the outside of the water droplets and continue to grow resulting in the interconnection of different coaggregates to form a larger floc structure. In addition, correlation between viscoelasticity and microstructure evolution of waxy crude oil emulsions of different water contents was discussed. With increasing water contents, the microstructure is changed from wax crystal flocculation structure as the main skeleton and the emulsified water droplets embedded in it, into the aggregation of emulsified water droplets occupying the main position. When the number of wax crystals and water droplets reaches a certain ratio, did wax crystals form coaggregates with emulsified water droplets, and the remaining wax crystals formed an overall flocculation structure, the viscoelasticity of the waxy crude oil emulsion is the highest.

PAM Templating Mechanism for Synthesis of A Novel LiFePO_4 Cathode Material

A novel templated LiFePO_4 cathode material was prepared with linear polyacrylamide, which exhibited excellent electrochemical properties, such as a 109.3 mA·h/g capacity at a rate of C/3 and a 120 mA·h/g capacity at a rate of C/6 as well as a good cycliability. We proposed the templating mechanism based upon the precursors′ TG-DTA curves, X-ray diffraction patterns and FTIR spectra of the samples at different temperatures. A tapping-mode atomic force microscope was used to investigate the surfaces of the end products. We found that the polyacrylamide template produced metal organic compounds in the cross-linked gel precursor, and thereby modified the crystallization and particle surfaces during calcining. The template was “removed” in the end, which was partially pyrolyzed into the spiral carbon to form a conductive network with nanocrys\|talline LiFePO_4 highly monodispersed in it.

Study of the Adherence Mechanism Between the Metal and Inorganic Coating with Mill Addition of Li_2Ni_8O_(10) Nano Powder

The adherence strength between the metal and the inorganic coating can be greatly increased by mill addition of Li2Ni8O10. The interface structure between metal and the inorganic coating with excellent adherence has been studied by investigating the chemical composition and the microstrncture as well as elements valence bond on the interface with the help of scanning electron microscope （SEM）, electron microprobe, and Auger elctron spectroscope （AES）. The results show that there is a non-stoichiometrieal transitional layer on the interface between metal and the inorganic coating with excellent adherence, the adherence between metal and the non-stoichiometrical transitional layer is achieved by the metallic bond and the adherence between the non- stoichiometrical transitional layer and the inorganic coating is produced by ionic and covalent bond. The non-stoichiometrical transitional layer results in the strong adherence.

Macroscopic Elastic Constants of Pure Metal Based on the Interactions between Microscopic Particles

The research activities of the calculation of the elastic constants of metal are mainly focused on the elastic constants of crystal at the micro level. To the calculation of the macroscopic elastic constants of metal, although molecular dynamics method and quasicontinuum method can be used, but there are shortcomings in them, such as a large amount of computation and that the spatial scale of the study model is limited. Therefore, with a pure metal thin plate composed of a single layer of microscopic particles as research object, a new mechanical model is established after the interactions between microscopic particles of the thin plate are applied on the continuum mechanics model of the thin plate. According to this model, the calculation formulas for the microscopic elastic constants, which are the elastic constants of any triangle region in the model, are obtained. After the concept of the ideal micro structure is presented, the calculation formulas for the macroscopic elastic constants, the elastic modulus and the Poisson’s ratio of pure metal are obtained, where the Poisson＇s ratio is the constant that is equal to 1？3. As an example, the elastic constants and the elastic modulus of pure copper are solved, where c11 is 175.811 GPa, c12 is 58.604 GPa, c33 is 58.604 GPa and E is 156.277 GPa, the rationality and the correctness of the model are verified. The model presented fully embodies the discreteness of the microstructure of solid, is a development to the continuum model, and is more suitable to reality, more simplified and more new to the study of the macroscopic elastic constants of pure metal.

Microstructures and deformation mechanisms of experimentally deformed gabbro

The natural gabbro samples were deformed at temperature ranging from 700 to 1150 ℃ with strain rate steps of 1 ×10^-4, 2.5 ×10^-5, 6.3 ×10^-6 s^-1. The mechanical data show that sample experiences gradual transition from semi-brittle flow to plastic flow, corresponding to a systematically decreasing stress exponent n with the increasing temperature ranging from 16.5 to 4.1 （He et al. Sci China （D） 46（7）：730-742, 2003）. We investigate microstructures and deformation mechanisms of experimentally deformed gabbro under transmission electron microscope in this study. For low temperature of 700 ℃ to 950℃, the deformation is mainly accommodated with dislocation glide and mechanical twinning, corresponding to stress exponent lager than 5, which means semi-brittle deformation. Whereas with higher temperature up to 1000 ℃-1150 ℃, the deformation is accommodated mainly with dislocation glide and climb corresponding to stress exponent of 4.1, which means plastic deformation. Evidence of dislocation climb has been found as dislocation walls in plagioclase. The observed slip system in plagioclase is （001）1/21110] and that in clinopyroxene are （100）[001] and （010）[001]. The （010）[001] slip system in clinopyroxene is newly found in this work. Melt was found at temperature of 950 ℃-1050 ℃. The melt glass distributed both in melt thin film between two grain boundaries and melt tubules of triangular along three grain boundaries at temperature of 950℃-1000℃. The melt triangular interconnected to the melt film at temperature of 1050 ℃-1150℃, where the melt chemical compositiondifferentiated into iron-rich dark dots and silicate-rich matrix.