Structurally Flexible 2D Spacer for Suppressing the Electron-Phonon Coupling Induced Non-Radiative Decay in Perovskite Solar Cells

This study presents experimental evidence of the dependence of non-radiative recombination processes on the electron-phonon coupling of perovskite in perovskite solar cells(PSCs).Via A-site cation engineering,a weaker electron-phonon coupling in perovskite has been achieved by introducing the structurally soft cyclohexane methylamine(CMA^(+))cation,which could serve as a damper to alleviate the mechanical stress caused by lattice oscillations,compared to the rigid phenethyl methylamine(PEA^(+))analog.It demonstrates a significantly lower non-radiative recombination rate,even though the two types of bulky cations have similar chemical passivation effects on perovskite,which might be explained by the suppressed carrier capture process and improved lattice geometry relaxation.The resulting PSCs achieve an exceptional power conversion efficiency(PCE)of 25.5%with a record-high opencircuit voltage(V_(OC))of 1.20 V for narrow bandgap perovskite(FAPbI_(3)).The established correlations between electron-phonon coupling and non-radiative decay provide design and screening criteria for more effective passivators for highly efficient PSCs approaching the Shockley-Queisser limit.

A novel electron-phonon coupling thermoelasticity with Burgers electronic heat transfer

The electron-phonon interaction can reveal the microscopic mechanism of heat transfer in metals.The two-step heat conduction considering electron-phonon interaction has become an effective theoretical model for extreme environments,such as micro-scale and ultrafast processes.In this work,the two-step heat transfer model is further extended by considering the Burgers heat conduction model with the secondorder heat flux rate for electrons.Then,a novel generalized electron-phonon coupling thermoelasticity is proposed with the Burgers electronic heat transfer.Then,the problem of one-dimensional semi-infinite copper strip subject to a thermal shock at one side is studied by the Burgers two-step(BTS)model.The thermoelastic analytical solutions are systematically derived in the Laplace domain,and the numerical Laplace inversion method is adopted to obtain the transient responses.The new model is compared with the parabolic two-step(PTS)model and the hyperbolic two-step(HTS)model.The results show that in ultrafast heating,the BTS model has the same wave front jump as the HTS model.The present model has the faster wave speed,and predicts the bigger disturbed regions than the HTS model.More deeply,all two-step models also have the faster wave speeds than one-step models.This work may benefit the theoretical modeling of ultrafast heating of metals.

Prediction of novel layered indium halide superconductors

We design two new layered indium halide compounds LaOInF_(2)and LaOInCl_(2)by means of first-principles calculations and evolutionary crystal structure prediction.We find both compounds crystallize in a tetragonal structure with P4/nmm space group and have indirect band gaps of 2.58 eV and 3.21 eV,respectively.By substituting O with F,both of them become metallic and superconducting at low temperature.The F-doping leads to strong electron-phonon coupling in the low-energy acoustic phonon modes which is mainly responsible for the induced superconductivity.The total electron-phonon coupling strength are 1.86 and 1.48,while the superconducting transition temperature(T_(c))are about 7.2 K and 6.5 K with 10%and 5%F doping for LaOInF_(2)and LaOInCl_(2),respectively.

Polaronic Electron-Phonon Interactions on the Third-Harmonic Generation in a Square Quantum Well

The influence of electron-phonon interactions on third-harmonic generation in a square quantum well is investigated. The first- and third-harmonic generation coefficient is obtained by using compact-density-matrix approach and iterative method, and the numerical results are presented for a GaAs square quantum well. The results show that the third-harmonic generation coefficient is obviously enhanced after considering the influence of electron-phonon interactions.

Measurements of electron-phonon coupling factor and interfacial thermal resistance of metallic nano-films using a transient thermoreflectance technique

Using a transient thermoreflectance （TTR） technique, several Au films with different thicknesses on glass and SiC substrates are measured for thermal characterization of metMlic nano-films, including the electron phonon coupling factor G, interfazial thermal resistance R, and thermal conductivity Ks of the substrate. The rear heating-front detecting （RF） method is used to ensure the femtosecond temporal resolution. An intense laser beam is focused on the rear surface to heat the film, and another weak laser beam is focused on the very spot of the front surface to detect the change in the electron temperature. By varying the optical path delay between the two beams, a complete electron temperature profile can be scanned. Different from the normally used single-layer model, the double-layer model involving interfaciM thermal resistance is studied here. The electron temperature cooling profile can be affected by the electron energy transfer into the substrate or the electron-phonon interactions in the metallic films. For multiple-target optimization, the genetic algorithm （GA） is used to obtain both G and R. The experimental result gives a deep understanding of the mechanism of ultra-fast heat transfer in metals.

Photo-Induced Ultrafast Electron Dynamics in Anatase and Rutile TiO_(2):Effects of Electron-Phonon Interaction

The photo-induced ultrafast electron dynamics in both anatase and rutile TiO_(2) are investigated by using the Boltzmann transport equation with the explicit incorporation of electron-phonon scattering rates.All structural parameters required for dynamic simulations are obtained from ab initio calculations.The results show that although the longitudinal optical modes significantly affect the electron energy relaxation dynamics in both phases due to strong Fr?hlich-type couplings,the detailed relaxation mechanisms have obvious differences.In the case of a single band,the energy relaxation time in anatase is 24.0 fs,twice longer than 11.8 fs in rutile.This discrepancy is explained by the different diffusion distributions over the electronic Bloch states and different scattering contributions from acoustic modes in the two phases.As for the multiple-band situation involving the lowest six conduction bands,the predicted overall relaxation times are about 47 fs and 57 fs in anatase and rutile,respectively,very different from the case of the single band.The slower relaxation in rutile is attributed to the existence of multiple rate-controlled steps during the dynamic process.The present findings may be helpful to control the electron dynamics for designing efficient TiO_(2)-based devices.

Effects of Electron-Phonon Interaction on Linear and Nonlinear Optical Absorption in Cylindrical Quantum Wires

The electron-phonon interaction influences on lineax and nonfineax optical absorption in cylindrical quantum wires （CQW） with an infinite confining potential axe investigated. The optical absorption coefficients are obtained by using the compact-density-matrix approach and iterative method, and the numerical results are presented for GaAs CQW. The results show that the electron-phonon interaction makes a distinct influence on optical absorption in CQW. The electron-phonon interaction on the wave functions of electron dominates the values of absorption coefficients and the correction of the electron-phonon effect on the energies of the electron makes the absorption peaks blue shift and become wider. Moreover, the electron-phonon interaction influence on optical absorption with an infinite confining potential is different from that with a finite confining potential.

Improved Ligand-Field Theory with Effect of Electron-Phonon Interaction

Traditional ligand-field theory has to be improved by taking into account both 'pure electronic' contribution and electron-phonon interaction one (including lattice-vibrational relaxation energy). By means of improved ligand-field theory, R1, R2, R'3, R'2, and R'1 lines, U band, ground-state zero-field-splitting (GSZFS), and ground-state g factors of ruby and/or GSGG: Cr3+ as well as thermal shifts of GSZFS, R1 line and R2 line of ruby have been calculated.The results are in very good agreement with the experimental data. Moreover, it is found that the value of cubic-field parameter given by traditional ligand-field theory is inappropriately large. For thermal shifts of GSZFS, R1 line and R2 line of ruby, several conclusions have also been obtained.

Propagating Optical Phonon Modes and Their Electron-Phonon Interaction Hamiltonians in Asymmetric Wurtzite Nitride Semiconductor Quantum Wells

Within the framework of the dielectric continuum model and Loudon ＇s uniaxial crystal model, the properties of frequency dispersion of the propagating （PR） optical phonon modes and the coupling functions of electron-PR phonons interaction in an asymmetrical wurtzite quantum well （QW） are deduced and analyzed via the method of electrostatic potential expanding. Numerical calculation on an asymmetrical Alo.25Gao.75N/GaN/Alo.15Gao.ssN wurtzite QW were performed. The results reveal that there are infinite branches of PR phonon modes in the systems. The behaviors of frequency forbidden of PR modes in the asymmetric QWs have been clearly observed. The mathematical and physical origins for these features have been analyzed in depth. The PR optical phonon branches have been distinguished and labelled reasonably in terms of the oscillating properties of the PR modes in the well-layer material. Moreover, the amplitudes and frequency properties of the electron-PR modes coupling functions in the barrier and well materials have also been analyzed from both of the mathematical and physical viewpoints.

Electron-Phonon Interaction in an Annular Quantum Dot

The confined longitudinal-optical （LO） phonon and surface-optical （SO） phonon modes of a free-standing annular cylindrical quantum dot are derived within the framework of dielectric continuum approximation. It is found that there exist two types of SO phonon modes： top SO （TSO） mode and side SO（SSO） mode in a cylindrical quantum annulus. Numerical calculation on CdS annulus system has been performed. Results reveal that the two different solutions of SSO mode distribute mainly at the inner or outer surfaces of the annulus. The dispersion relations and the coupling intensions of phonons in a quantum annulus are compared with those in a cylindrical quantum dot. It is found that the dispersion relations of the two different structures are similar, but the coupling intension of the phonon-electron interaction in quantum annulus is larger than that in quantum dot. The Hamiltonians describing the free phonon modes and their interactions with electrons in the system are also derived.

PERSISTENT CURRENT IN A ONE-DIMENSIONAL MESOSCOPIC RING WITH ELECTRON-PHONON INTERACTION IN THE LATTICE MODEL

A new non-perturbative method is used to discuss the persistent current in a one-dimensional mesoscopic ring threaded by a flux φ with electron-phonon interaction in the lattice model. The current is periodic in φ with a flux quantum φ 0 and the electron-phonon interaction suppresses the persistent current. By considering the contributions of many-phonon correlations, we could obtain more accurate results.

Electron-phonon coupling in cuprate and iron-based superconductors revealed by Raman scattering

Electron-phonon coupling （EPC） in cuprate and iron-based superconducting systems, as revealed by Raman scat- tering, is briefly reviewed. We introduce how to extract the coupling information through phonon lineshape. Then we discuss the strength of EPC in different high-temperature superconductor （HTSC） systems and possible factors affecting the strength. A comparative study between Raman phonon theories and experiments allows us to gain insight into some crucial electronic properties, especially superconductivity. Finally, we summarize and compare EPC in the two existing HTSC systems, and discuss what role it may play in the HTSC.

Dynamic Deformation Electron-Phonon Interaction in Disordered Bulk Semiconductor

We present our theoretical investigations on the effects of disorder on the electron-phonon interaction in semiconducting GaAs system. Both the temperature (T) and disorder (electron mean free path l) dependences of the electron-phonon scattering rate have been determined. On consideration of the dynamic screening, we find a significant change in the temperature exponent as well as the pre factor from the earlier reported temperature power law dependence result ?T6 obtained under static screening. Also the dynamic screening makes a noticeable change in the character of the dependence of scattering rate on the mean free path from the static screening result.

Pressure-Induced Shift of R-Line of MgO：Cr^3＋ with Electron-Phonon Interaction Effect

By means of improved ligand-field theory, the ＂pure electronic＂ pressure-induced shift （PS） and the PS due to electron-phonon interaction （EPI） of R-line of MgO：Cr^3＋ have been calculated, respectively. The calculated results are in very good agreement with the experimental data. The behaviors of the pure electronic PS of R-line of MgO：Cr^3＋ and the PS of its R-line due to EPI are different. It is the combined effect of them that gives rise to the total PS of R-line, which has satisfactorily explained the experimental results. The comparison between the feature of R-line PS of MgO：Cr^3＋ and that of R1-line PS of ruby has been made.

Review of phonons in moiré superlattices

Moirépatterns in physics are interference fringes produced when a periodic template is stacked on another similar one with different displacement and twist angles.The phonon in two-dimensional(2D)material affected by moirépatterns in the lattice shows various novel physical phenomena,such as frequency shift,different linewidth,and mediation to the superconductivity.This review gives a brief overview of phonons in 2D moirésuperlattice.First,we introduce the theory of the moiréphonon modes based on a continuum approach using the elastic theory and discuss the effect of the moirépattern on phonons in 2D materials such as graphene and MoS_(2).Then,we discuss the electron-phonon coupling(EPC)modulated by moirépatterns,which can be detected by the spectroscopy methods.Furthermore,the phonon-mediated unconventional superconductivity in 2D moirésuperlattice is introduced.The theory of phonon-mediated superconductivity in moirésuperlattice sets up a general framework,which promises to predict the response of superconductivity to various perturbations,such as disorder,magnetic field,and electric displacement field.

First-principles study of the bandgap renormalization and optical property ofβ-LiGaO_(2)

Theβ-LiGaO_(2)with an orthorhombic wurtzite-derived structure is a candidate ultrawide direct-bandgap semiconductor.In this work,using the non-adiabatic Allen-Heine-Cardona approach,we investigate the bandgap renormalization arising from electron-phonon coupling.We find a sizable zero-point motion correction of-0.362 eV to the gap atΓ,which is dominated by the contributions of long-wavelength longitudinal optical phonons.The bandgap ofβ-LiGaO_(2)decreases monotonically with increasing temperature.We investigate the optical spectra by comparing the model Bethe-Salpether equation method with the independent-particle approximation.The calculated optical spectra including electron-hole interactions exhibit strong excitonic effects,in qualitative agreement with the experiment.The contributing interband transitions and the binding energy for the excitonic states are analyzed.

Phonon-assisted upconversion photoluminescence of quantum emitters

Quantum emitters are widely used in quantum networks,quantum information processing,and quantum sensing due to their excellent optical properties.Compared with Stokes excitation,quantum emitters under anti-Stokes excitation exhibit better performance.In addition to laser cooling and nanoscale thermometry,anti-Stokes excitation can improve the coherence of single-photon sources for advanced quantum technologies.In this review,we follow the recent advances in phononassisted upconversion photoluminescence of quantum emitters and discuss the upconversion mechanisms,applications,and prospects for quantum emitters with anti-Stokes excitation.

Purity-dependent Lorenz number,electron hydrodynamics and electron-phonon coupling in WTe_(2)

We present a study of electrical and thermal transport in Weyl semimetal WTe_(2)down to 0.3 K.The Wiedemann-Franz law holds below 2 K and a downward deviation starts above.The deviation is more pronounced in cleaner samples,as expected in the hydrodynamic picture of electronic transport,where a fraction of electron-electron collisions conserve momentum.Phonons are the dominant heat carriers and their mean-free-path does not display a Knudsen minimum.This is presumably a consequence of weak anharmonicity,as indicated by the temperature dependence of the specific heat.Frequent momentum exchange between phonons and electrons leads to quantum oscillations of the phononic thermal conductivity.Bloch-Grüneisen picture of electron-phonon scattering breaks down at low temperature when Umklapp ph-ph collisions cease to be a sink for electronic flow of momentum.Comparison with semi-metallic Sb shows that normal ph-ph collisions are amplified by anharmonicity.In both semimetals,at cryogenic temperature,e-ph collisions degrade the phononic flow of energy but not the electronic flow of momentum.

GaAs-GaAlAs量子阱中光极化子

本文计及子带跃迁和双声子过程,计算了限制在量子阱中光极化子能级,给出了自陷能和重正化质量数值计算结果,它是阱宽的函数.发现自陷能和有效质量在二维结果和三维结果之间,子带跃迁和双声子过程对自陷能的贡献不是很重要的.

Polar Quasi-Confined Optical Phonon Modes in Wurtzite Quasi-One-Dimensional GaN/Al_xGa_(1-x)N Quantum Well Wires

Based on the dielectric continuum model and Loudon＇s uniaxial crystal model,quasi-confined （QC） optical phonon modes and electron-QC phonon coupling functions in quasi-one-dimensional （QID） wurtzite quantum well wires （QWWs） are deduced and analyzed. Numerical calculations on an AIN/GaN/AIN wurtzite QWW are performed. The results reveal that the dispersions of the QC modes are quite obvious only when the free wavenumber kz in the z-direction and the azimuthal quantum number m are small. The reduced behavior of the QC modes in wurtzite quantum systems is clearly observed. Through the discussion of the electron-QC mode coupling functions,it is found that the lower-frequency QC modes in the high-frequency region play a more important role in the electron-QC phonon interactions. Moreover,our computations also prove that kz and m have a similar influence on the electron-QC phonon coupling properties.