Electronic structure and effective mass of pristine and Cl-doped CsPbBr_(3)

Organic–inorganic lead halide perovskites(LHPs) have attracted great interest owing to their outstanding optoelectronic properties.Typically,the underlying electronic structure would determinate the physical properties of materials.But as for now,limited studies have been done to reveal the underlying electronic structure of this material system,comparing to the huge amount of investigations on the material synthesis.The effective mass of the valance band is one of the most important physical parameters which plays a dominant role in charge transport and photovoltaic phenomena.In pristine CsPbBr_(3),the Fr?hlich polarons associated with the Pb–Br stretching modes are proposed to be responsible for the effective mass renormalization.In this regard,it would be very interesting to explore the electronic structure in doped LHPs.Here,we report high-resolution angle-resolved photoemission spectroscopy(ARPES) studies on both pristine and Cl-doped CsPbBr_(3).The experimental band dispersions are extracted from ARPES spectra along both ■ and ■ high symmetry directions.DFT calculations are performed and directly compared with the ARPES data.Our results have revealed the band structure of Cl-doped CsPbBr_(3) for the first time,which have also unveiled the effective mass renormalization in the Cl-doped CsPbBr_(3) compound.Doping dependent measurements indicate that the chlorine doping could moderately tune the renormalization strength.These results will help understand the physical properties of LHPs as a function of doping.

Volcanism at the Permian-Triassic Boundary in South China and Its Effects on Mass Extinction

This paper discusses the clayrocks widespread at the Permian-Triassic boundary, which are mostly of volcanic origin. Volcanogenetic textures, structures and minerals such as high-temperature quartz are found in clayrocks at the Permian-Triassic boundary in many places. Thousands of microspherules have been collected from the Boundary clayrocks, many of which exhibit the typical features of the process from melting to cooling and solidification. indicating that they were formed by volcanic eruption or extraterrestrial impact. Volcanic effects on the Permian-Triassic mass extinction may be reflected in conodonts, algae and ammonoids. The Boundary clayrocks are found in many Permian-Triassic sections along the coast of Tethys. Their orighin remains to be studied.

Mixed convective heat and mass transfer analysis for peristaltic transport in an asymmetric channel with Soret and Dufour effects

The present investigation addresses the simultaneous effects of heat and mass transfer in the mixed convection peristaltic flow of viscous fluid in an asymmetric channel. The channel walls exhibit the convective boundary conditions. In addition, the effects due to Soret and Dufour are taken into consideration. Resulting problems are solved for the series solutions. Numerical values of heat and mass transfer rates are displayed and studied. Results indicate that the concentration and temperature of the fluid increase whereas the mass transfer rate at the wall decreases with increase of the mass transfer Biot number. Furthermore, it is observed that the temperature decreases with the increase of the heat transfer Biot number.

The Approximate Analytical Solution of Non-Linear Equation for Simultaneous Internal Mass and Heat Diffusion Effects

For the first time a mathematical modelling of porous catalyst particles subject to both internal mass concentration gradients as well as temperature gradients, in endothermic or exothermic reactions has been reported. This model contains a non-linear mass balance equation which is related to rate expression. This paper presents an approximate analytical method (Modified Adomian decomposition method) to solve the non-linear differential equations for chemical kinetics with diffusion effects. A simple and closed form of expressions pertaining to substrate concentration and utilization factor is presented for all value of diffusion parameters. These analytical results are compared with numerical results and found to be in good agreement.

Probing nucleon effective mass splitting with light particle emission

The main objective of this study was to investigate the impact of effective mass splitting on heavy-ion-collision observables.We first analyzed correlations between different nuclear matter parameters obtained from 119 effective Skyrme interaction sets.The values of the correlation coefficients illustrate that the magnitude of effective mass splitting is crucial for tight constraints on the symmetry energy via heavy-ion collisions.The^(86)Kr+^(208)Pb system at beam energies ranging from 25 to 200A MeV was simulated within the framework of the improved quantum molecular dynamics model(ImQMD-Sky).Our calculations show that the slopes of the spectra of ln[Y(n)/Y(p)]and ln[Y(t)/Y(^(3)He)],which are the logarithms of the neutron to proton and triton to helium-3 yield ratios,are directly related to effective mass splitting and can be used to probe the effective mass splitting.

Discussion on the Electron and Hole Effective Masses in Thermal Silicon

This review and research study provides conclusive discussion on the electron and hole effective masses in thermal silicon dioxide placing their values at 0.42m and 0.58m,where m is the free electron mass,correct to two decimal places.Only one of the masses needs to be determined as the electron and hole masses in materials add up to be equal to free electron mass with the hole effective mass being larger than the electron effective mass.The review also convinces the reader that the CBO(conduction band offset)or the Si-SiO2 barrier height at the oxide/silicon interface of a Si MOS(metal-oxide-semiconductor)device is 3.20 eV.

An Analytical Model of Drain Current for Ultra-Thin Body and Double-Gate Schottky Source/Drain MOSFETs Accounting for Quantum Effects

A compact drain current including the variation of barrier heights and carrier quantization in ultrathin-body and double-gate Schottky barrier MOSFETs （UTBDG SBFETs） is developed. In this model, Schrodinger＇s equation is solved using the triangular potential well approximation. The carrier density thus obtained is included in the space charge density to obtain quantum carrier confinement effects in the modeling of thin-body devices. Due to the quantum effects, the first subband is higher than the conduction band edge, which is equivalent to the band gap widening. Thus, the barrier heights at the source and drain increase and the carrier concentration decreases as the drain current decreases. The drawback of the existing models,which cannot present an accurate prediction of the drain current because they mainly consider the effects of Schottky barrier lowering （SBL） due to image forces,is eliminated. Our research results suggest that for small nonnegative Schottky barrier （SB） heights,even for zero barrier height, the tunneling current also plays a role in the total on-state currents. Verification of the present model was carried out by the device numerical simulator-Silvaco and showed good agreement.

Effective Mass of Strong-Coupling Bound Polaron in a Triangular Quantum Well Induced by Rashba Effect

In this paper, on the basis of Huybrechts＇ strong-coupling polaron model, the Tokuda modified linearcombination operator method and the unitary transformation method are used to study the properties of the strongcoupling bound polaron considering the influence of Rashba effect, which is brought by the spin-orbit （SO） interaction, in the semiconductor triangular quantum well （TQW）. Numerical calculation on the RbCI TQW, as the example, is performed. The expressions for the effective mass of the polaron as a function of the vibration frequency, the velocity, the Coulomb bound potential and the electron areal density are derived. Numerical results show that the total effective mass of the polaron is composed of three parts. The interactions between the orbit and the spin with different directions have different effects on the effective mass of the bound polaron.

Magnitude and Forming Factors of Mass Elevation Effect on Qinghai-Tibet Plateau

Mass elevation effect （MEE） refers to the thermal effect of huge mountains or plateaus, which causes the tendency for tem- perature-related montane landscape limits to occur at higher elevations in the inner massifs than on their outer margins. MEE has been widely identified in all large mountains, but how it could be measured and what its main forming-factors are still remain open. This paper, supposing that the local mountain base elevation （MBE） is the main factor of MEE, takes the Qinghai-Tibet Plateau （QTP） as the study area, defines MEE as the temperature difference （AT） between the inner and outer parts of mountain massifs, identifies the main forming factors, and analyzes their contributions to MEE. A total of 73 mountain bases were identified, ranging from 708 m to 5081 m and increasing from the edges to the central parts of the plateau. Climate data （1981-2010） from 134 meteorological stations were used to acquire ATby comparing near-surface air temperature on the main plateau with the free-air temperature at the same altitude and simi- lar latitude outside of the plateau. The AT for the warmest month is averagely 6.15 ~C, over 12~C at Lhatse and Baxoi. A multivariate linear regression model was developed to simulate MEE based on three variables （latitude, annual mean precipitation and MBE）, which are all significantly correlated to AT. The model could explain 67.3% of MEE variation, and the contribution rates of three independent variables to MEE are 35.29%, 22.69% and 42.02%, respectively. This confirms that MBE is the main factor of MEE. The intensive MEE of the QTP pushes the 10~C isotherm of the warmest month mean temperature 1300-2000 m higher in the main plateau than in the outer regions, leading the occurrence of the highest timberline （4900 m） and the highest snowline （6200 m） of the Northern Hemisphere in the southeast and southwest of the plateau, respectively.

Probing neutron–proton effective mass splitting using nuclear stopping and isospin mix in heavy-ion collisions in GeV energy region

The ramifications of the effective mass splitting on the nuclear stopping and isospin tracer during heavy-ion collisions within the gigaelectron volt energy region are studied using an isospin-dependent quantum molecular dynamics model.Three isotope probes,i.e.,a proton,deuteron,and triton,are used to calculate the nuclear stopping.Compared to the mn*>mp*case,the mn*<mp*parameter results in a stronger stopping for protons but a weaker stopping for tritons.The calculations of the isospin tracer show that the mn*>mp*parameter results in a higher isospin mix than the mn*<mp*parameter.The rapidity and impact parameter dependences of the isospin tracer are also studied.A constraining of the effective mass splitting using the free nucleons with high rapidity and in a central rather than peripheral collision is suggested.

Remarks on Exact Solvability of Quantum Systems with Spatially Varying Effective Mass

Within the frame of a novel treatment we make a complete mathematical analysis of exactly solvable onedimensional quantum systems with non-constant mass, involving their ordering ambiguities. This work extends the results recently reported in the literature and clarifies the relation between physically acceptable effective mass Hamiltonians.

What factors determine the mass elevation effect of the Tibetan Plateau?

The mass elevation effect(MEE)of the Tibetan Plateau(TP)has attracted the attention of geographers because of its significant influence on the Asian climate,snow line,timberline,and other important climate-ecological boundaries of the plateau and on global ecological patterns.In recent years,much progress has been made in quantifying the MEE of TP.However,factors that affect the size of MEE have not been examined in depth,and the key factors still remain unclear.Based on quantification of MEE for each mountain basal elevation plot,this study identifies the factors that contribute significantly to MEE of the plateau.Seven factors are considered,including mountain basal elevation,distance from the core zone of MEE,thermal continentality,maximum elevation,height difference,area,and difference of underlying surface(with the yearly max"Normalized Difference Vegetation Index"(NDVI)serving as a quantitative indicator).We also used these seven factors as independent variables to develop a multiple linear regression model for MEE of the plateau.Results show that:(1)the determination coefficient(R2)of the model reaches as high as 0.877,and the contributions of mountain basal elevation,distance from the core zone of MEE,thermal continentality,maximum elevation,topographical height difference,area,and NDVI are 39.77%,23.02%,14.48%,5.78%,11.41%,2.92%,and 2.62%,respectively,with mountain basal elevation and the distance from the core of MEE as the most important factors;(2)thermal continentality and MEE are significantly correlated,and maximum elevation only has a coupling relationship with MEE,with height difference and NDVI contributing little to MEE.This study deepens our understanding of MEE and its forming factors in the Tibetan Plateau.

First-principles investigation of electronic structure,effective carrier masses, and optical properties of ferromagnetic semiconductor CdCr_2S_4

The electronic structures, the effective masses, and optical properties of spinel CdCr_2S_4 are studied by using the fullpotential linearized augmented planewave method and a modified Becke–Johnson exchange functional within the densityfunctional theory. Most importantly, the effects of the spin–orbit coupling（SOC） on the electronic structures and carrier effective masses are investigated. The calculated band structure shows a direct band gap. The electronic effective mass and the hole effective mass are analytically determined by reproducing the calculated band structures near the BZ center.SOC substantially changes the valence band top and the hole effective masses. In addition, we calculated the corresponding optical properties of the spinel structure CdCr_2S_4. These should be useful to deeply understand spinel CdCr_2S_4 as a ferromagnetic semiconductor for possible semiconductor spintronic applications.

Theoretical Study on the Mass Transfer of Metal Ions in Ion Exchange Process

The kinetics of ion exchange between Ca2+, Mg2+, Co(Ⅱ), Cu(Ⅱ),Ni(Ⅱ), Fe(Ⅲ), y3+ or Sm3+ , respectively, in 0.50 mol/L HC1 and H+ on macrorecticular sulfonic ion exchange resin and the kinetics of the same reactions (M -H exchange) when Mn(Ⅱ) coexisted in resin phase as accelerating ion were studied. The accelerating effect manifested and its rule are consistent with the accelerating effect theory based on the concept concerned with adsorption electrical double layer which has been suggested in a previous paper published.

Comparative analysis of the mass elevation effect and its implication for the treeline between the Tibetan and Bolivian plateaus based on solar radiation

As one of the main non-zonal factors,the mass elevation effect(MEE)has significant impacts on both regional climates and mountain ecological patterns.In recent years,with the development of quantitative techniques and methods,quantitative studies on the MEE and its implication on mountain altitudinal belts have developed rapidly.However,some issues have not been solved yet,such as high errors in spatial temperature estimations and difficulties in the definition and extraction of intramountain base elevation.Moreover,there is still a lack of comparative studies on the MEE and its influence on treelines and snowlines as most studies were conducted on specific mountains or plateaus.To compare the MEE magnitudes of the Tibetan Plateau(TP)and the Bolivian Plateau(BP),we estimated the correspondent air temperatures and simulated the solar radiations based on MODIS surface temperature,station observation,and treeline data.Then,we analyzed the elevation of the 10℃isotherms on the two plateaus,the temperatures at the same elevation,and the solar radiations.According to the mechanism of the MEE and the relationship of solar radiation and treeline,we constructed treeline models for the two plateaus through a stepwise regression analysis by considering several influencing factors of the MEE(e.g.,air temperature and precipitation)and using solar radiation as its proxy.The results showed that:(1)the MEE magnitude on the TP is equivalent to that on the BP although the former is slightly higher than the latter;(2)the MEE strongly influences the highest treelines in the northern and southern hemispheres,which both occur on the two plateaus.Notably,the treeline distribution models based on solar radiation had higher accuracies than those models with parameters of temperature and precipitation(the adjusted R^(2) values were 0.76 for the TP and 0.936 for the BP),indicating that solar radiation can be used to quantify the MEE and its implications on treelines.Overall,the results of this study can serve as a basis for subsequent analyses on the MEE’s impact factors.

Two-Layer High-Throughput:Effective Mass Calculations Including Warping

In this paper,we perform two-layer high-throughput calculations.In the first layer,which involves changing the crystal structure and/or chemical composition,we analyze selected Ⅲ-Ⅴ semiconductors,filled and unfilled skutterudites,as well as rock salt and layered chalcogenides.The second layer searches the full Brillouin zone(BZ)for critical points within 1.5 eV(1 eV=1.602176×10^(-19)J)of the Fermi level and characterizes those points by computing the effective masses.We introduce several methods to compute the effective masses from first principles and compare them to each other.Our approach also includes the calculation of the density-of-states effective masses for warped critical points,where traditional approaches fail to give consistent results due to an underlying non-analytic behavior of the critical point.We demonstrate the need to consider the band structure in its full complexity and the value of complementary approaches to compute the effective masses.We also provide computational evidence that warping occurs only in the presence of degeneracies.

Effect of hydrostatic pressure and polaronic mass of the binding energy in a spherical quantum dot

Simultaneous effect of hydrostatic pressure and polaronic mass on the binding energies of the ground and excited states of an on-center hydrogenic impurity confined in a GaAs/GaA1As spherical quantum dot are theoretically investigated by the variational method within the effective mass approximation. The binding energy is calculated as a function of dot radius and pressure. Our findings proved that the hydrostatic pressure led to the decrease of confined energy and the increase of donor binding energy. Conduction band non-parabolicity and the polaron masses are effective in the donor binding energy which is significant for narrow dots not in the confined energy. The maximum donor binding energy achieved by the polaronic mass in the ground and excited states are 2%-19% for the narrow dots. The confined and donor binding energies approach zero as the dot size approaches infinity.

Semiclassical Method to Schroedinger Equation with Position-Dependent Effective Mass

In this paper, two novel semiclassical methods including the standard and supersymmetric WKB quantization conditions are suggested to discuss the Schroedinger equation with position-dependent effective mass. From a proper coordinate transformation, the formalism of the Schroedinger equation with position-dependent effective mass is mapped into isospectral one with constant mass and therefore for a given mass distribution and physical potential function the bound state energy spectrum can be determined easily by above method associated with a simple integral formula. It is shown that our method can give the analytical results for some exactly-solvable quantum systems.

Lowering plasma frequency by enhancing the effective mass of electrons: A route to deep sub-wavelength metamaterials

Deep sub-wavelength metamaterials are the key to the further development of practical metamaterials with small volumes and broadband properties. We propose to reduce the electrical sizes of metamaterials down to more sub-wavelength scales by lowering the plasma frequencies of metallic wires. The theoretical model is firstly established by analyzing the plasma frequency of continuous thin wires. By introducing more inductance elements, the effective electron mass can be enhanced drastically, leading to significantly lowered plasma frequencies. Based on this theory, we demonstrate that both the electric and the magnetic plasma frequencies of metamaterials can be lowered significantly and thus the electrical sizes of metamaterials can be reduced to more sub-wavelength scales. This provides an efficient route to deep sub-wavelength metamaterials and will give rigorous impetus for the further development of practical metamaterials.

Neutron Star Magnetic Field as for Nonzero Photon Mass

We investigate the neutron star magnetic field by the relative mean-field theory, where the photon effective mass depending on baryon density of charged particles is nonzero. This field is produced by star itself, which is the function of baryon density. The result fits the observations.