Evolution Of Configuration Research Articles

Revealing the Dynamic Evolution of Electrolyte Configuration on the Cathode-Electrolyte Interface by Visualizing (De) Solvation Processes.

Electrolyte engineering is crucial for improving cathode electrolyte interphase (CEI) to enhance the performance of lithium-ion batteries, especially at high charging cut-off voltages. However, typical electrolyte modification strategies always focus on the solvation structure in the bulk region, but consistently neglect the dynamic evolution of electrolyte solvation configuration at the cathode-electrolyte interface, which directly influences the CEI construction. Herein, we reveal an anti-synergy effect between Li+-solvation and interfacial electric field by visualizing the dynamic evolution of electrolyte solvation configuration at the cathode-electrolyte interface, which determines the concentration of interfacial solvated-Li+. The Li+ solvation in the charging process facilitates the construction of a concentrated (Li+-solvent/anion-rich) interface and anion-derived CEI, while the repulsive force derived from interfacial electric field induces the formation of a diluted (solvent-rich) interface and solvent-derived CEI. Modifying the electrochemical protocols and electrolyte formulation, we regulate the "inflection voltage" arising from the anti-synergy effect and prolong the lifetime of the concentrated interface, which further improves the functionality of CEI architecture.

The Minkowski vacuum of stochastic composite gravity

We present a first analysis of a nonperturbative approach to quantum gravity based on a representation of quantum field theory in terms of stochastic processes. The stochastic description accommodates a physical Lorentz-invariant ultraviolet regulator that provides a novel description of physics at ultra-short distances. In a scalar toy model, we demonstrate the evolution of a generic initial field configuration toward an equilibrium in which the composite spacetime metric fluctuates about a flat spacetime. As a diffeomorphism-invariant theory with locally Lorentz-invariant regulator, fluctuations about the vacuum are expected to give rise to an emergent gravitational interaction consistent with Einstein gravity at long distances. We uncover a formal similarity between regularization by stochastic discreteness and point-splitting regularization in the corresponding quantum field theory. We comment on the signature of the emergent spacetime, possible consequences for the early universe, and the potential for observational and experimental tests of the stochastic origin of quantum field theory and gravitation.

Basement Configuration and Tectonic Evolution Beneath Zallah Trough, Western Sirt Basin, Libya, Obtained from Integrated Gravity, and Aeromagnetic Data

In this study, gravity and aeromagnetic datasets are analysed to map fault systems and the depth of the basement, which has hitherto been unknown. The gravity and magnetic data were provided by the Libyan Petroleum Institute. Low-pass filters separated local and regional components of gravity and aeromagnetic datasets, as well as the CET grid analysis filter, Euler deconvolution, Source Parameter Imaging (SPI) estimate of crystalline basement depth, Werner deconvolution, and 2D forward modelling. The results show the fault patterns, primarily trends, are NE-SW, N-S, and NW-SE, which define and constrain the trough. Some structural characteristics in the centre and southern trough have an NNE-SSW orientation with estimated depth ranging from (400 to 5350) m as resulted by Euler deconvolution. The SPI technique estimates the crystalline basement at about 5200 m. The Werner solution showed volcanic bodies in the form of sills; in addition, it approved that these volcanic bodies have depths of 4366m and 5067 m, respectively. Thle observed sill bodies may have been the result of the Sirt Basin rifting, causing a weakening of the crust to allow mantle flow. The 2D modelling showed that the depth of the basement ranges between (5100 and 5400) m beneath the depocenter of the study area.

Tectonic structures of SW margin of Gondwana from gravity and magnetic anomalies of the Río de la Plata area and their correlation with the Beattie magnetic Anomaly in South Africa

The Río de la Plata cratonic area and the adjacent continental platform (South America) have been subject of geophysical and tectonic studies for several decades. However, there are still many uncertainties related with its structural configuration and tectonic evolution. To deepen the knowledge of the tectono-structural characteristics of the cratonic and surrounding areas, we carried out an analysis of magnetic and gravity anomalies, which is highly effective in accurately locating the boundaries of crustal/lithospheric domains/terrains and structures. Additionally, this tectonic characterization allows us to correlate South American geophysical features with their counterparts in southern South Africa (i.e., Beattie Magnetic Anomaly).In this study, different filters and techniques were employed to analyze magnetic and gravity anomalies. The gravity anomaly was obtained from global models, whereas the magnetic anomaly was compiled from diverse sources (aerial, terrestrial, and marine data). Particularly, the first vertical derivative, total horizontal derivative, analytic signal, tilt angle and upward continuations were calculated, and 3D Euler Deconvolution was applied.Our results confirm the existence, and accurately determine the location, of Río Negro and Colorado transfer zones, Sierra de la Ventana Shear Zone, and extensional structures in the Tandilia System area, here defined as Tandil Trough. Moreover, we propose that the Sierra de la Ventana Shear Zone was shifted northwards in the offshore sector of the study area through sinistral displacement along the Punta Mogotes Shear Zone. Considering the similar rheological contrasts exhibited by the South African margin, we suggest an analogous configuration in the case of the Cape Fold Belt. Additionally, based on our interpretations, and considering previous geophysical studies, we support the proposal that the Beattie Magnetic Anomaly in South Africa and the magnetic anomaly detected beneath the Claromecó Basin would be generated by comparable sources (i.e., Sierra de la Ventana Shear Zone).

Recycling of subducted continent slab in an accretionary orogen: Insight from the Liangwan potassic granitoids in the Tongbai orogen, Central China

Granitoids provide a vital window to probe the lithological configuration and chemical evolution of orogenic belts. In this contribution, we present an integrated study of mineral compositions, zircon UPb ages and HfO isotopes, titanite UPb ages and SmNd isotopes, as well as whole-rock element and Sr–Nd–Hf isotope compositions of the Liangwan granitic pluton in the northern Paleozoic accretionary orogenic unit of the Tongbai orogen, central China. The Liangwan pluton is composed mainly of monzogranites and contains abundant mafic microgranular enclaves (MMEs). The monzogranites have relatively high silica contents (SiO2 = 67.40–69.91 wt%) and mainly exhibit shoshonite to high-K calc-alkaline and metaluminous features. The MMEs have similar mineral and geochemical compositions and zircon and titanite UPb ages of ca. 129 Ma to the monzogranites, suggesting that they are likely early-crystalized cumulates of the host monzogranites. The MMEs and monzogranites are both characterized by enrichment of large ion lithophile elements but depletion of high field-strength elements. The monzogranites have whole-rock initial Sr (Isr) of 0.7069–0.7074, εNd(t) of −14.2 to −13.7, and εHf(t) of −17.5 to −17.2, zircon εHf(t) of −17.8 to −17.0 and δ18O values of 5.27–5.98 ‰, and titanite εNd(t) of −14.50 to −13.78. These features are distinct from the rocks in the northern Tongbai accretionary orogenic unit but similar to those of the post-collisional granitoids in the southern Tongbai collisional orogenic unit. The Liangwan pluton was likely stemmed from the subducted South China Block (SCB) underneath the northern segment of the Tongbai orogen. Our results show that the subducted continental mass can act as an alternative source for the magmatic rocks occurred in the accretionary unit.

Revealing the Dynamic Evolution of Electrolyte Configuration on the Cathode‐Electrolyte Interface by Visualizing (De) Solvation Processes

AbstractElectrolyte engineering is crucial for improving cathode electrolyte interphase (CEI) to enhance the performance of lithium‐ion batteries, especially at high charging cut‐off voltages. However, typical electrolyte modification strategies always focus on the solvation structure in the bulk region, but consistently neglect the dynamic evolution of electrolyte solvation configuration at the cathode‐electrolyte interface, which directly influences the CEI construction. Herein, we reveal an anti‐synergy effect between Li+‐solvation and interfacial electric field by visualizing the dynamic evolution of electrolyte solvation configuration at the cathode‐electrolyte interface, which determines the concentration of interfacial solvated‐Li+. The Li+ solvation in the charging process facilitates the construction of a concentrated (Li+‐solvent/anion‐rich) interface and anion‐derived CEI, while the repulsive force derived from interfacial electric field induces the formation of a diluted (solvent‐rich) interface and solvent‐derived CEI. Modifying the electrochemical protocols and electrolyte formulation, we regulate the “inflection voltage” arising from the anti‐synergy effect and prolong the lifetime of the concentrated interface, which further improves the functionality of CEI architecture.

Anisotropic model observing pulsars from Neutron Star Interior Composition with modified Van der Waals equation of state

This paper is designed for heavy pulsars coming from the Neutron Star Interior Composition Explorer. The research model is describe by Einstein field equations for anisotropic fluid configuration with spherical symmetry. As per present perceptiveness, modified non-linear Van der Waals equation of state is used to relate physical variables. The continuity of inner and outer matter is obtained by comparing inner spacetime to outer Schwarzschild metric. The physical viability of this model is evaluated and further it is compared with observational data of pulsars PSR J0348+0432, PSR J0740+6620 and PSR J0030+0451. The model fulfils all physical and mathematical characteristics of the dense structure studies. It offers the factual proofs carried by evolution of celestial configurations. The working model presented here is physically viable and shows stable behaviour.

Comparison on Hysteresis Loops and Dislocation Configurations in Fatigued Face-Centered Cubic Single Crystals

The aggregation and evolution of dislocations form different configurations, which are the preferred locations for fatigue crack initiation. To analyze the spatial distribution of the same dislocation configuration and the resulting configuration morphologies on different observation planes, several typical hysteresis loops and dislocation configurations in fatigued face-centered cubic single crystals with various orientations were compared. The crystal orientations of these specimens were determined by the electron back-scattering diffraction technique in a Cambridge S360 Scanning Electron Microscope. It is well known that dislocation ladder and wall structures, as well as patch and vein structures, are distributed on their respective observation planes, (12¯1) and (111). These correspond to the point defect direction and line defect direction of dislocations, respectively. Therefore, the wall structures on the (12¯1) and (111) planes consist of point defects and line defects, which can be defined as point walls and line walls, respectively. Furthermore, the walls on the (12¯1) plane consist of Persistent Slip Band ladders connected with each other, corresponding to the formation of deformation bands. The evolution of dislocation patterns follows a process from patch to ladder and from vein to wall. The formation of labyrinths and dislocation cells originates from the activation of different secondary slip systems. In one word, it can help us better understand the physical nature of metal fatigue and failure by studying the distribution and evolution of different configurations.

Comprehensive Analysis and Development of Electric-Drive-Wheel with Idler Gear

This paper provides a comprehensive analysis of the electric-drive-wheel (EDW) with idler gear. From the perspective of automotive engineering, the EDW is an integrated execution unit that combines the function of powertrain and suspension. As a result, the research on EDW involves the intersection of multiple disciplines. The evolution of idler gear configuration requires some geometric constraints. Under this premise, the longitudinal and vertical dynamic characteristics of the system were studied, respectively. There are several factors that influence the system performance, such as the gear parameters, the position of the electric motor, and the suspension K&C value. The principles of each parameter on the output indicators were studied, with an optimized plan and simulation comparison to check the correctness of theory. In the end, the prototype was equipped with a test bench, covering a wide range of working operations to examine the expected performance of EDW design. The step response test of the EDW result showed a balanced performance in transmission smoothness and responsiveness agility.

Novel Design and Performance Analysis of 1R1T Remote Center-of-Motion Mechanisms With Partially Decoupled T- and R-Motions

Abstract Remote center-of-motion (RCM) mechanisms provide a way for surgical instruments to pass through a remote center (e.g., skin incision) under geometrical constraints, facilitating safer operations in minimally invasive surgery (MIS). One rotation and one translation (1R1T, pitch and insertion) are the basic requirements for RCM mechanisms. To make the structure simpler and control easier, a novel concept of 1R1T RCM mechanisms with partially decoupled motions, inspired by the double-parallelogram 1R RCM mechanisms, is proposed in this article, by investigating and proving its motion combination principle based on the screw theory. New evolution procedures based on the configuration evolution method have been derived to design 1R1T RCM mechanisms based on two approaches of inserting the T-motion in an original 1R RCM mechanism, resulting in two types of 1R1T RCM mechanisms with partially decoupled motions and base-locating actuators. The kinematic models of one typical proposed mechanism (including the forward and inverse kinematics) and its Jacobian matrix are derived. The performance analysis is presented, including RCM validation, velocity, singularity, and workspace analysis. Then, the dimensional optimization based on the discrete solution method is derived. Finally, a prototype of the proposed mechanism is presented with preliminary experiments performed to verify the feasibility of the synthesized RCM mechanisms. The results show that the RCM mechanism performs the 1R1T partially decoupled motion, and it can be used as the basic element of an active manipulator of an MIS robot.

Evolution of the two-neutron configuration from 11Li to 13Li

In this work we investigate the two-neutron decay of 13Li and of the excited states of 11Li populated via one-proton removal from 14Be and 12Be, respectively. A phenomenological model is used to describe the decay of 11Li and 13Li. While the first one displays important sequential components, the second one appears dominated by the direct two-neutron decay. A microscopic three-body model is used to extract information on the spatial configuration of the emitted neutrons before the decay and shows that the average distance between the neutrons increases going from 11Li to 13Li.

In situ tuning of platinum 5d valence states for four-electron oxygen reduction

The oxygen reduction reaction (ORR) catalyzed by efficient and economical catalysts is critical for sustainable energy devices. Although the newly-emerging atomically dispersed platinum catalysts are highly attractive for maximizing atomic utilization, their catalytic selectivity and durability are severely limited by the inflexible valence transformation between Pt and supports. Here, we present a structure by anchoring Pt atoms onto valence-adjustable CuOx/Cu hybrid nanoparticle supports (Pt1-CuOx/Cu), in which the high-valence Cu (+2) in CuOx combined with zero-valent Cu (0) serves as a wide-range valence electron reservoir (0‒2e) to dynamically adjust the Pt 5d valence states during the ORR. In situ spectroscopic characterizations demonstrate that the dynamic evolution of the Pt 5d valence electron configurations could optimize the adsorption strength of *OOH intermediate and further accelerate the dissociation of O = O bonds for the four-electron ORR. As a result, the Pt1-CuOx/Cu catalysts deliver superior ORR performance with a significantly enhanced four-electron selectivity of over 97% and long-term durability.

Pappus phenotypes and flight performance across evolutionary history in the daisy family.

Diversity in pappus shapes and size in Asteraceae suggests an adaptive response to dispersion challenges adjusting diaspores to optimal phenotypic configurations. Here, by analysing the relationship among pappus-cypsela size relationships, flight performance and pappus types in an evolutionary context, we evaluate the role of natural selection acting on the evolution of diaspore configuration at a macro-ecological scale in the daisy family. To link pappus-cypsela size relationships with flight performance we collected published data on these traits from 82 species. This allowed us to translate morphometric traits in flight performance for 150 species represented in a fully resolved backbone phylogeny of the daisy family. Through ancestral reconstructions and evolutionary model selection, we assessed whether flight performance was associated with and constrained by different pappus types. Additionally, we evaluated, through phylogenetic regressions, whether species with different pappus types exhibited evolutionary allometric pappus-cypsela size relationships. The setose pappus type had the highest flight performances and represented the most probable ancestral state in the family. Stepwise changes in pappus types independently led from setose to multiple instances of pappus loss with associated reduction in flight performance. Flight performance evolution was best modelled as constrained by five adaptive regimes represented by specific pappus types which correspond to specific optimal diaspore configurations that are distinct in pappus-cypsela allometric relationships. Evolutionary modelling suggests natural selection as the main factor of diaspore configuration changes which proceeded towards five optima, often overcoming constraints imposed by allometric relationships and favouring evolution in certain directions. With the perspective that natural selection is the main process driving the observed patterns, various biotic and abiotic are suggested as principal drivers of transitions in diaspore configurations along space and time in the daisy family history. The results also allow discussion of evolutionary changes in a historical context.

Molecular understanding of the self-assembly of an N-isopropylacrylamide delivery system for the loading and temperature-dependent release of curcumin

Global changes and drug abuse are forcing humanity to face various disease problems, and alternative therapies with safe natural substances have important research value. This paper combines various techniques in quantum chemical calculations and molecular simulations to provide molecular-level insight into the dynamics of the self-assembly of N-isopropylacrylamide (NIPAM) for loading curcumin (CUR). The results indicate that increasing the chain length of NIPAM molecules reduces their efficiency in encapsulating and locking CUR, and electrostatic interactions and van der Waals interactions are the main driving forces behind the evolution of system configurations in these processes. The isopropyl groups of NIPAM and the two phenolic ring planes of CUR are the main contact areas for the interaction between the two types of molecules. The thermosensitive effect of NIPAM can alter the distribution of isopropyl groups in NIPAM molecules around CUR. As a result, when the temperature rises from ambient temperature (300 K) to human characteristic temperature (310 K), the NIPAM-CUR interactions and radial distribution functions suggest that body temperature is more suitable for drug release. Our findings offer a vital theoretical foundation and practical guidance for researchers to develop temperature-sensitive drug delivery systems tailored for CUR, addressing its clinical application bottleneck.

Cyclic deformation behavior and damage mechanism of 316H stainless steel under low-cycle fatigue loading at 650 °C

Low-cycle fatigue tests were conducted at 650 °C to investigate the cyclic deformation behavior and damage mechanism of 316H stainless steel at various strain amplitudes ranging from 0.2 % to 1.0 %. The relationship between macroscopic deformation properties and microscopic physical mechanisms was revealed based on the comprehensive analysis of local deformation misorientation and dislocation microstructure. Results showed that the 316H stainless steel presented non-Masing behavior at strain amplitudes lower than 0.6 %, and Masing behavior at strain amplitudes larger than 0.6 %, which was primarily attributed to the evolution of dislocation configurations. The crack initiation and propagation behavior at 0.2 % strain amplitude, characterized by the transgranular mode, was dominated by fatigue. However, the intergranular damage became dominant at the strain amplitude larger than 0.2 %, due to the intensified strain localization at grain boundaries. Moreover, the plastic strain energy was used for life assessment with the consideration of non-Masing behavior.

Study on Grain Boundary Mechanical Behaviors of Polycrystalline γ-TiAl Using Molecular Dynamics Simulations

In this study, the molecular dynamics (MD) method was used to study the tensile deformation of polycrystalline γ-TiAl with complex and random grain orientations. Firstly, the tensile deformation was simulated with different average grain sizes (8.60 nm, 6.18 nm, and 4.50 nm) and strain rates (1 × 108 s−1, 5 × 108 s−1, and 1 × 109 s−1). The results show that the peak stress increases with an increase in tensile strain rate, and the peak stress decreases as the grain size decreases, showing an inverse Hall–Petch effect. Upon observing atomic configuration evolution during tensile deformation, it is found that the grain boundary is seriously distorted, which indicates obvious grain boundary sliding occurring. With a further increase in the loading, some dislocations nucleate at the grain boundaries and propagate towards the interior of the grains along the grain boundaries, which demonstrates that dislocation motion is the primary coordination of the mechanical process of the grain boundaries. The dislocation density near the grain boundaries continues to increase, leading to the generation of micro-cracks and eventually causing material failure. Another interesting phenomenon is that the grains rotate, and the specific rotation angle values of each grain are quantitatively calculated. Grain rotation relaxes the stress concentration near the grain boundaries and plays a toughening role. Consequently, the plastic deformation behaviors of polycrystalline γ-TiAl are achieved through the grain boundary mechanical process, that is, grain boundary sliding and grain rotation.

Data-driven urban configuration optimization: An XGBoost-based approach for mitigating flood susceptibility and enhancing economic contribution

The indiscriminate evolution of urban configurations aggravates flood vulnerabilities, threatening sustainable urban expansion. Present methodologies fall short in supplying urban planners with flood mitigative strategies centered on urban configuration facets. Leveraging the power of the XGBoost algorithm, this study posits an advanced optimization schema, adroitly balancing the dual objectives of mitigating urban flooding and enhancing economic growth, with minimal disruption to established urban layouts. Shenzhen serves as the investigative ground, where the model displays exceptional accuracy, resilience, and interpretability in predicting Pluvial Flooding Susceptibility (PFS) and Economic Contribution (EC). Model interpretation divulges the profound influence of three-dimensional urban configuration elements, primarily the Building Congestion Degree, on PFS and EC. Pareto solution exploration for multi-objective optimization unveils the ideal urban configuration interval. To minimize PFS while maximizing EC, the research suggests pertinent measures: augmenting vegetation density, regulating the impervious coverage ratio within 50–70%, limiting two- and three-dimensional building density thresholds, and moderately escalating urban drainage network density. Additionally, it encourages a comprehensive appreciation of function-oriented land usage and intrinsic site topographical characteristics to reconcile varied urban development goals during planning. By fusing data-derived insights with multi-objective optimization, this research anticipates influencing urban planning models, thus enhancing decision-making related to urban configuration and fostering flood-resilient, sustainable, and economically prosperous urban habitats.

Study on Confined Water in Flexible Graphene/GO Nanochannels.

The structural evolution of flexible nanochannels within a 2D material membrane, influenced by the ingress of water molecules, plays a crucial role in the membrane's filtration and structural stability. However, the experimental observation of nanoscale water is challenging, and current studies mostly focus on rigid nanochannels. Further investigation on the nanoconfined water is urgently needed, considering the flexibility and deformation of the channel. In this work, MD simulations and theoretical analyses are conducted to investigate the water structure and thermodynamic properties when confined within both rigid and flexible graphene/graphene oxide (GO) nanochannels. In free rigid graphene nanochannels, the interlayer distance exhibits a quantized increase with the number of water molecules, along with sudden changes in entropy, potential energy, and free energy of the water molecules. Meanwhile, in flexible graphene nanochannels, the average interlayer space increases linearly with the number of water molecules. In free rigid GO nanochannels, with the increase of oxidation concentration, the quantized increase in the interlayer space gradually diminishes, accompanied by a decrease in both potential energy and free energy. This work provides insights into the configurational evolution of flexible nanochannels within water, offering guidance in fields such as desalination and mass transport of 2D material membranes.

Cross-sectional geometrical characteristic for the bends along the lower Jingjiang reach

The evolution of bar–pool configurations in response to upstream damming has significant impacts on channel regulations, navigations, water intakes and protection projects. This paper reports on and analyses the evolution of bar–pool configurations in bends along the lower Jingjiang reach (LJR) after the impoundment of the Three Gorge dam (TGD), which is distinguished from the natural evolution of the bends. The main factors in the different adjustments of bar–pool configurations are the changes in incoming flow and sediment regime during pre- and post-TGD periods. To capture the changes in the bar–pool configurations, a new cross-sectional geometrical characteristic is presented – relative lateral distance of the centroid (RLDC). RLDC has close relations with the incoming sediment coefficient (i.e. incoming discharge divided by suspended sediment concentration during flood season). RLDC is better than the conventional cross-sectional geometrical characteristic (e.g. width-to-depth ratio) to indicate the bar–pool configurations downstream of large dam projects. Based on the delayed response model, values of RLDC in the bends of the LJR are related to the previous 4–6 years’ incoming sediment coefficient, and the correlation coefficient is about 0.90. RLDC is expected to capture the variations of bar–pool configurations in the bends downstream of the large dam project.

Topological Electronic Transition Contributing to Improved Thermoelectric Performance in p-Type Mg3Sb2- xBix Solid Solutions.

Topological electronic transition is the very promising strategy for achieving high band degeneracy (NV) and for optimizing thermoelectric performance. Herein, this work verifies in p-type Mg3Sb2- xBix that topological electronic transition could be the key mechanism responsible for elevating the NV of valence band edge from 1 to 6, leading to much improved thermoelectric performance. Through comprehensive spectroscopy characterizations and theoretical calculations of electronic structures, the topological electronic transition from trivial semiconductor is unambiguously demonstrated to topological semimetal of Mg3Sb2- xBix with increasing the Bi content, due to the strong spin-orbit coupling of Bi and the band inversion. The distinct evolution of Fermi surface configuration and the multivalley valence band edge with NV of 6 are discovered in the Bi-rich compositions, while a peculiar two-step band inversion is revealed for the first time in the end compound Mg3Bi2. As a result, the optimal p-type Mg3Sb0.5Bi1.5 simultaneously obtains a positive bandgap and high NV of 6, and thus acquires the largest thermoelectric power factor of 3.54 and 6.93 µW cm-1 K-2 at 300 and 575 K, respectively, outperforming the values in other compositions. This work provides important guidance on improving thermoelectric performance of p-type Mg3Sb2- xBix utilizing the topological electronic transition.