Macro and micro mechanics behavior of granite after heat treatment by cluster model in particle flow code

In this paper, a cluster model in particle flow code was used to simulate granite specimens after heat treatment under uniaxial compression. The results demonstrated that micro-cracks are randomly distributed in the specimen when the temperature is below 300?C, and have partial coalescence when the temperature is up to 450?C, then form macro-cracks when the temperature is above 600?C. There is more inter-granular cracking than intra-granular cracking, and their ratio increases with increasing temperature.The micro-cracks are almost constant when the temperature decreases from 900?C to room temperature, except for quartz α–β phase transition temperature(573?C). The fracture evolution process is obviously affected by these cracks, especially at 600–900?C. Elevated temperature leads to easily developed displacement between the grains, and the capacity to store strain energy becomes weaker, corresponding to the plasticity of granite after heat treatment.

Cluster modeling of the short-range correlation of acoustically emitted scattering signals

As a widely used measurement technique in rock mechanics,spatial correlation modeling of acoustic emission(AE)scattering signals is attracting increasing focus for describing mechanical behavior quantitatively.Unlike the statistical description of the spatial distribution of randomly generated AE signals,spatial correlation modeling is based mainly on short-range correlation considering the interrelationship of adjacent signals.As a new idea from percolation models,the covering strategy is used to build the most representative cube cluster,which corresponds to the critical scale at peak stress.Its modeling process of critical cube cluster depends strongly on the full connection of the main fracture network,and the corresponding cube for coverage is termed the critical cube.The criticality pertains to not only the transition of local-to-whole connection of the fracture network but also the increasing-to-decreasing transition of the deviatoric stress with an obvious stress drop in the brittle failure of granite.Determining a reasonable critical cube guarantees the best observation scale for investigating the failure process.Besides,the topological connection induces the geometric criticality of three descriptors,namely anisotropy,pore fraction,and specific surface area,which are evaluated separately and effectively.The results show that cluster modeling based on the critical cube is effective and has criticality in both topology and geometry,as well as the triaxial behavior.Furthermore,the critical cube length presents a high confidence probability of being correlated to the mineral particle size.Besides,its pore fraction of cube cluster is influenced strongly by the critical cube length and confining pressure.

Study on electronic density topology of various cluster models of Mg/Al hydrotalcite by density functional theory

The geometry and electronic topology properties of Mg/Al hydrotalcite cluster models were comparatively investigated by means of density functional theory at GGA/DND levels.The results suggested that cluster model containing seven octahedral cations was the smallest size to be employed to simulate other properties.The fact that the n＋ charge of cluster models containing n aluminum atoms can reflect electronic properties of anionic clay layer sheet.The bond lengths of clusters can be modified by terminating with or without OH-/H2O groups in terms of principle of bond order conservation.

SELECTING CLUSTER MODEL IN Sn - BASED SOLDER ALLOY DESIGN WITH DV - X_α CALCULATION METHOD

Applying calculation method in alloy design should be an important tendency due to its characters of inexpensive cost, high efficiency and prediction. DOS calculations of AuSn, AsSn and SbSn Sn- based alloys have been investigated by employing DV - Xa method, in which different cluster models were adopted to calculate electron structure.It is proved that some regulations must be taken into ac- count in order to carry out alloy design calculation successfully,which are described in this paper in detail.

Projection pursuit cluster model and its application in water quality assessment

One of the difficulties frequently encountered in water quality assessment is that there are many factors and they cannot be assessed according to one factor, all the effect factors associated with water quality must be used. In order to overcome this issues the projection pursuit principle is introduced into water quality assessment, and projection pursuit cluster(PPC) model is developed in this study. The PPC model makes the transition from high dimension to one-dimension. In other words, based on the PPC model, multifactor problem can be converted to one factor problem. The application of PPC model can be divided into four parts: (1) to estimate projection index function Q(); (2) to find the right projection direction ; (3) to calculate projection characteristic value of the i th sample z-i, and (4) to draw comprehensive analysis on the basis of z-i. On the other hand, the empirical formula of cutoff radius R is developed, which is benefit for the model to be used in practice. Finally, a case study of water quality assessment is proposed in this paper. The results showed that the PPC model is reasonable, and it is more objective and less subjective in water quality assessment. It is a new method for multivariate problem comprehensive analysis.

Theoretical study of NO adsorbed on the surface of TiO2（110） cluster model

The chemisorption properties of N^18O adsorption on TiO2(110) surface were investigated by experimental and theoretical methods. The results of temperature programmed desorption (TPD) indicated that the temperatures of the three desorption peaks of the main N2 molecules were at (low) temperature of 230 K, 450 K, and (high) temperature of 980 K. This meant that N^18O decomposed and recombined during the process of N2 desorption after N^18O was exposed. Analysis of thestable combination and orbital theory calculation of the surface reaction of NO adsorption on the TiO2(110) cluster modelshowed that there was clear preference for the Ti-NO orientation.

A theoretical study on different cluster configurations of the ~9Be nucleus by using a simple cluster model

In this study,a comprehensive investigation on different cluster configurations of the ~9Be nucleus is performed with a simple cluster approach.With this goal,the elastic scattering angular distributions of ~9Be by ^(27)A1,^(28)Si,^(64)Zn,^(144)Sm,^(208)Pb,and ^(209)Bi target nuclei are reanalyzed for α + α + n,d + ~7Li,~3H + ~6Li,~3He + ~6He and n + ~8Be cluster configurations of the ~9Be projectile within the framework of the optical model.The theoretical results are compared with each other as well as the experimental data.The results provide an opportunity for a test of different cluster configurations in explaining the elastic scattering of^9Be nucleus.

Cluster Model of Formation of Subnuclear and Subatomic Objects

The paper describes the development results on one-dimensional (1D) asymptotic model of the formation kinetics for the objects (clusters) of subnuclear (quark) and subatomic (nuclear) matters. A concept of the objects distribution density wave φ(a, t) in space of sizes a lies in the basis for analytical description of the processes under consideration. The proposed formalism makes it possible to describe in an adequate way the final outcomes of the well-known catastrophic phenomena in the world of elementary particles. Mass characteristics of different processes of approach to equilibrium in nuclear reactions are calculated.

Density Functional Study of the Cluster Model of SnO₂(110) Surface Modified by Benzoic Acids

The properties of the modified surface of SnO2(110) with benzoic acid (Y-C6H4-COOH: Y is para position relative to -COOH group) derivatives were investigated using density functional theory. Zehner et al. mentioned that the modification of surface dipole moment made it possible to tune the work function of the system. The experiment of Ganzorig et al. showed that there was a linear relationship between the dipole moment of the binding molecule and the work function change of the system using the modified surface of indium-tin oxide (ITO) with some benzoic acid derivatives. To elucidate the relation between the dipole moment of the molecule and the work function change, we investigated the modified surface of SnO2(110) using Sn7O14 cluster model which was embedded in the fixed point charges. On the modification of the surface, benzoic acid derivatives were bound to SnO2 surface. By changing the terminal group of benzoic acid with H, Cl, F, CF3 and CCl3, the work function changed and the dipole moment of the binding molecules of the modified SnO2(110) were evaluated. The results showed that there was a linear relationship between the dipole moment of the binding molecules and the work function changed. From this relation, the average value of the dipole moments of Sn-OOC linkage at the surface was also evaluated.

Astrophysical S-factor and reaction rate for 15N(p,γ)16O within the modified potential cluster model

We study radiative p^(15)N capture on the ground state of ^(16)O at stellar energies within the framework of a modified potential cluster model(MPCM)with forbidden states,including low-lying resonances.The investigation of the ^(15)N(p,γ0)^(16)O reaction includes the consideration of ^(3)S_(1) resonances due to E1 transitions and the contribution of the ^(3)P_(1) scattering wave in the p+^(15)N channel due to the ^(3)P_(1)→^(3)P_(0)M1 transition.We calculated the astrophysical low-energy S-factor,and the extrapolated S(0)turned out to be within 34.7−40.4 keV·b.The important role of the asymptotic constant(AC)for the ^(15)N(p,γ0)16O process with interfering ^(3)S_(1)(312)and ^(3)S_(1)(962)resonances is elucidated.A comparison of our calculation for the S-factor with existing experimental and theoretical data is addressed,and a reasonable agreement is found.The reaction rate is calculated and compared with the existing rates.It has negligible dependence on the variation of AC but shows a strong impact of the interference of ^(3)S_(1)(312)and ^(3)S_(1)(962)resonances in reference to the CNO Gamow windows,especially at low temperatures.We estimate the contribution of cascade transitions to the reaction rate based on the exclusive experimental data from Phys.Rev.C.85,065810(2012).The reaction rate enhancement due to the cascade transitions is observed from T_(9)>0.3 and reaches the maximum factor~1.3 at T_(9)=1.3.We present the Gamow energy window and a comparison of rates for radiative proton capture reactions ^(12)N(p,γ)^(13)O,^(13)N(p,γ)^(14)O,^(14)N(p,γ)^(15)O,and ^(15)N(p,γ)^(16)O obtained in the framework of the MPCM and provide the temperature windows,prevalence,and significance of each process.

Radiative^(9)Be(n,γ0+1+2+3+4+5)^(10)Be reaction rate in the potential cluster model

Within the framework of the modified potential cluster model with forbidden states,the total cross-sections of radiative n^(9)Be capture to the ground and five low-lying excited states are calculated at energies from 10^(-2)eV up to 5 MeV.The thermal cross-section σ_(th)=8.35mb is in good agreement with experimental data.We considered five resonances at the excitation energies E_(x)from 7.371 MeV up to 10.570 MeV corresponding to the following states with J^(π)(E_(x),MeV):3^(-)(7.371),2^(+)(7.542),3^(+)(9.4),2^(+)(9.56),and 3^(-)(10.570).The partial and total ^(9)Be(n,γ0+1+2+3+4+5)^(10)Be reaction rates are calculated at temperatures from 0.001 to 10 T_(9).Contrary to the available data,we propose that the rise in the reaction rate near factor five at T_(9)>1 is mainly due to the first 3^(-)(E_(R)=0.559 MeV)resonance.We foresee this contrast as arising from different model approaches.

Estimation of radiative capture^(13)B(n,γ0+1)^(14)B reaction rate in the modified potential cluster model

We discuss current attempts to employ the modified potential cluster model to describe the available experimental data on the^(13)B(n,γ0+1)^(14)B total cross-sections.The estimated results of the M1 and E1 transitions from the n^(13)B scattering states to the ground and first excited states of^(14)B are presented.The 1st resonance at Ex=1.275 MeV(1+)is revealed in both the cross-section and reaction rate.Within the variation in the asymptotic constant,a thermal cross-section interval of 5.1-8.9 mb is proposed.Based on the theoretical total cross-sections at energies of 0.01 eV to 5 MeV,we calculate the reaction rate in the temperature range of 0.01 to 10T9.The ignition T9 values of the^(13)B(n,γ0+1)^(14)B reaction depending on a neutron number density n_(n)of~10^(22)cm^(−3)are determined.The radiative neutron capture reaction rates on the boron^(10-13)B and carbon^(12-14)Сisotopes are compared.

基于Blending-Clustering集成学习的大坝变形预测模型

【目的】变形是反映大坝结构性态最直观的效应量,构建科学合理的变形预测模型是保障大坝安全健康运行的重要手段。针对传统大坝变形预测模型预测精度低、误报率高等问题导致的错误报警现象,【方法】选取不同预测模型和聚类算法集成,构建了一种Blending-Clustering集成学习的大坝变形预测模型,该模型以Blending对单一预测模型集成提升预测精度为核心,并通过Clustering聚类优选预测值改善模型稳定性。以新疆某面板堆石坝变形监测数据为实例分析,通过多模型预测性能比较,对所提出模型的预测精度和稳定性进行全面评估。【结果】结果显示:Blending-Clustering模型将预测模型和聚类算法集成,均方根误差(RMSE)和归一化平均百分比误差(nMAPE)明显降低,模型的预测精度得到显著提高;回归相关系数(R~2)得到提升,模型具备更强的拟合能力;在面板堆石坝上22个测点变形数据集上的预测评价指标波动范围更小,模型的泛化性和稳定性得到有效增强。【结论】结果表明:Blending-Clustering集成预测模型对于预测精度、泛化性和稳定性均有明显提升,在实际工程具有一定的应用价值。

Modelling the Survival of Western Honey Bee Apis mellifera and the African Stingless Bee Meliponula ferruginea Using Semiparametric Marginal Proportional Hazards Mixture Cure Model

Classical survival analysis assumes all subjects will experience the event of interest, but in some cases, a portion of the population may never encounter the event. These survival methods further assume independent survival times, which is not valid for honey bees, which live in nests. The study introduces a semi-parametric marginal proportional hazards mixture cure (PHMC) model with exchangeable correlation structure, using generalized estimating equations for survival data analysis. The model was tested on clustered right-censored bees survival data with a cured fraction, where two bee species were subjected to different entomopathogens to test the effect of the entomopathogens on the survival of the bee species. The Expectation-Solution algorithm is used to estimate the parameters. The study notes a weak positive association between cure statuses (ρ1=0.0007) and survival times for uncured bees (ρ2=0.0890), emphasizing their importance. The odds of being uncured for A. mellifera is higher than the odds for species M. ferruginea. The bee species, A. mellifera are more susceptible to entomopathogens icipe 7, icipe 20, and icipe 69. The Cox-Snell residuals show that the proposed semiparametric PH model generally fits the data well as compared to model that assume independent correlation structure. Thus, the semi parametric marginal proportional hazards mixture cure is parsimonious model for correlated bees survival data.

With the alpha-cluster model to explain the change of separating energy

It was supposed that, the nucleus was composed of α-cluster, pn-pair, and nn-pair. The reciprocity of the α-cluster, pn-pair, and nn-pair caused the regular change of the separating energy to separate the nn-pair in the exotic nuclei. The regular change was that the separating energy was high behind low to separate the nn-pair in the light and exotic nuclei. This phenomenon must had more profound physical meaning.

Deuteron inelastic scattering on ^(6)Li and ^(7)Li nuclei within the three-body cluster model

The problem of the deuteron interaction with lithium nuclei,treated as a system of two coupled pointlike clusters,is formulated to calculate the cross sections of the d+Li reaction.The d+Li reaction mechanism is described using the Faddeev theory for the three-body problem of deuteron-nucleus interaction.This theory is slightly extended for calculation of the stripping processes ^6Li(d,p)^7Li,^7Li(d,p)^8 ,^6Li(d,n)^7 Be,and ^7Li(d,n)^8 Be,as well as fragmentation reactions yielding tritium,a-particles,and continuous neutrons and protons in the initial deuteron kineticenergy region Ed=0.5-20 MeV.The phase shifts found for d+^6Li and d+^7Li elastic scattering,as part of the simple optic model with a complex central potential,were used to find the cross sections for the 6^Li(d,yM)^8 and ^7Li(d,yE1)^9 Be radiation captures.The three-body dynamics role is also summarized to demonstrate its significant influence within the d+^7Li system.

Load Cluster Characteristic and Modeling of EV Charge Station in Residential District

电动汽车的大规模发展将会对配电网带来较大影响,开展电动汽车充电的负荷特性研究是保证电网安全运行的前提,是引导电动汽车进行有序充电的基础。在简化锂电池恒流–恒压2阶段充电模型的基础上,得到单个电动汽车的充电模型,以此为基本元素,从充电汽车电池的初始荷电状态（initial state-of-charge,SOC0）和车辆到达充电站时间的随机分布为出发点,提出2阶段泊松分布的电动汽车充电站集聚模型进行充电站集聚特性的模拟,并提出基于充电站的日充电负荷曲线的电动汽车充电站负荷集聚模型的建模方法,最后通过仿真算例验证了其有效性。

The Accumulation of He on a W Surface During keV-He Irradiation:Cluster Dynamics Modeling

The accumulation of He on a W surface during keV-He ion irradiation has been simulated using cluster dynamics modeling. This is based mainly on rate theory and improved by involving different types of objects, adopting up-to-date parameters and complex reaction processes, as well as considering the diffusion process along with depth. These new features make the simulated results compare very well with the experimental ones. The accumulation and diffusion processes are analyzed, and the depth and size dependence of the He concentrations contributed by different types of He clusters is also discussed. The exploration of the trapping and diffusion effects of the He atoms is helpful in understanding the evolution of the damages in the near-surface of plasma-facing materials under He ion irradiation.