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Ultrafast Spin–Phonon Coupling Dynamics in BiFeO_(3)-Bi_(0.5)K_(0.5)TiO_(3)Single Crystal
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作者 Tao Li Zhou Wang +3 位作者 Lihua Yin Qinwen Lu Yifan Ren Zhigao Sheng 《Chinese Physics Letters》 2025年第7期288-297,共10页
Besides equilibrium behavior,exploring the spin–phonon coupling in multiferroic materials under non-equilibrium conditions is crucial for a deep understanding of the mechanisms as well as their high-frequency applica... Besides equilibrium behavior,exploring the spin–phonon coupling in multiferroic materials under non-equilibrium conditions is crucial for a deep understanding of the mechanisms as well as their high-frequency applications.Here,by utilizing time-resolved refectance spectroscopy,we demonstrate ultrafast spin–phonon coupling dynamics in multiferroic 0.58BiFeO_(3)-0.42Bi_(0.5)K_(0.5)TiO_(3)(BF-BKT)single crystals.With ultrafast laser pumping,coherent acoustic phonons with low damping are created in BF-BKT.Temperature-dependent results indicate that both the frequency and amplitude of laser-induced coherent phonons are sensitive to the emergence of antiferromagnetic order.Moreover,the spin state change driven by external magnetic felds can enhance the oscillation amplitude of the coherent acoustic phonons even above the magnetic Néel temperature.These fndings experimentally confrm that spin–phonon coupling in multiferroic materials exists not only in the spin-ordered state but also in the spin-disordered state,and not only in the equilibrium state but also in the non-equilibrium state excited by ultrafast lasers,suggesting their promising applications in high-frequency devices. 展开更多
关键词 ultrafast spin phonon coupling coherent acoustic phonons magnetic field ultrafast laser pumpingcoherent acoustic phonons multiferroic materials spin disordered state spin phonon coupling time resolved reflectance spectroscopy
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Single-Dislocation Phonons:Atomic-Scale Measurement and Their Thermal Properties
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作者 Yue-Hui Li Bo Han +12 位作者 Xiao-Long Yang Rui-Lin Mao Fa-Chen Liu Ruo-Chen Shi Rui-Shi Qi Xiao-Rui Hao Ning Li Bing-Yao Liu Xiao-Mei Li Jin-Long Du Ji Chen Wu Li Peng Gao 《Chinese Physics Letters》 2025年第6期110-139,共30页
Nanoscale defects such as dislocations have a significant impact on the phonon thermal transport properties in non-metallic materials.To unravel these effects,an understanding of defect phonon modes is essential.Herei... Nanoscale defects such as dislocations have a significant impact on the phonon thermal transport properties in non-metallic materials.To unravel these effects,an understanding of defect phonon modes is essential.Herein,at the atomic scale,the localized phonons of individual dislocations at a Si/Ge interface are measured via monochromated electron energy loss spectroscopy in a scanning transmission electron microscope.These modes are then correlated with the local microstructure,further revealing the dislocation effects on the local thermal transport properties.The dislocation causes a phonon redshift of several milli-electron-volts within about two to four nanometers of the core,where both the strain field and Ge segregation play roles.With the presence of dislocation,the local interfacial thermal conductance can be either enhanced or reduced,depending on the complex interaction and competition between lattice disorder(dislocation)and element disorder(heterointerface mixing and Ge-segregation)at the interface.These findings provide valuable insights to improve the thermal properties of thermoelectric generators and thermal management systems through proper defect engineering. 展开更多
关键词 localized phonons defect phonon modes scanning transmission electron microscopethese single dislocation phonons phonon thermal transport properties thermal transport properties monochromated electron energy loss spectroscopy scanning transmission electron microscope
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Phonon Angular Momentum Generation in Single-Stranded Helix Structure
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作者 Hong Sun Jiaqi Chen +3 位作者 Qingxuan Wang Xiaoliang Zeng Jun Zhou Lifa Zhang 《Chinese Physics Letters》 2025年第9期246-260,共15页
The experimental realization of observable phonon angular momentum(PAM)in feasible systems using relatively simple methods remains a critical challenge.Motivated by the chiral-induced spin selectivity effect,this stud... The experimental realization of observable phonon angular momentum(PAM)in feasible systems using relatively simple methods remains a critical challenge.Motivated by the chiral-induced spin selectivity effect,this study explores the generation of PAM during the transport of electrically driven polarons along a singlestranded helix structure.We demonstrate that the motion of a polaron under an applied electric field inherently induces a finite PAM,exhibiting drift-locked behavior between the PAM and the polaron.By analyzing the time evolution of PAM distribution at each site,we identify the observed PAM as a natural consequence of coherent superposition between lattice waves,in which the chiral structure selectively determines the direction of induced PAM.Furthermore,we examine the roles of two types of electron-phonon interactions and structural periodicity in modulating PAM.These findings highlight the potential of chiral molecules as platforms for PAM generation and offer new insights into developing phonon-spin-based devices for information processing and transmission. 展开更多
关键词 transport electrically driven polarons phonon angular momentum pam electron phonon interactions structural periodicity POLARONS singlestranded helix structurewe phonon angular momentum chiral molecules
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Magnetic-Mediated Carrier, Phonon and Spin Dynamics in the Ferromagnetic Semiconductor (In,Fe)Sb
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作者 K.Hu X.H.Zhu +2 位作者 H.L.Wang D.H.Wei J.Qi 《Chinese Physics Letters》 2025年第5期206-214,共9页
We investigate the carrier, phonon, and spin dynamics in the ferromagnetic semiconductor(In,Fe)Sb using ultrafast optical pump-probe spectroscopy. We discover two anomalies near T^(*)(~40 K) and T^(†)(~200 K) in the p... We investigate the carrier, phonon, and spin dynamics in the ferromagnetic semiconductor(In,Fe)Sb using ultrafast optical pump-probe spectroscopy. We discover two anomalies near T^(*)(~40 K) and T^(†)(~200 K) in the photoexcited carrier dynamics, which can be attributed to the electron-spin and spin-lattice scattering processes influenced by the magnetic phase transition and modifications in magnetic anisotropy. The magnetization change can be revealed by the dynamics of coherent acoustic phonon. We also observe abrupt changes in the photoinduced spin dynamics near T^(*)and T^(†), which not only illustrate the spin-related scatterings closely related to the long-range magnetic order, but also reveal the D'yakonov–Perel and Elliott–Yafet mechanisms dominating at temperatures below and above T^(†), respectively. Our findings provide important insights into the nonequilibrium properties of the photoexcited(In,Fe)Sb. 展开更多
关键词 magnetization change photoexcited carrier dynamics spin dynamics magnetic mediated carrier dynamics ferromagnetic semiconductor modifications magnetic anisotropy phonon dynamics coherent acoustic phonon
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Coupling between phonon and short-range spin correlations in frustrated spinel LiFeCr_(4)O_(8)
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作者 Xiang Li Wei Ren +6 位作者 Bo Zhang Yan-Zhen Cai Zhi-Wei Li Jianting Ji Feng Jin Anmin Zhang Qingming Zhang 《Chinese Physics B》 2025年第11期522-528,共7页
Spin-phonon coupling is important in chromate spinel oxides ACr_(2)O_(4),but its role in LiFeCr_(4)O_(8)is not well understood.In this paper,we employ Raman scattering and first-principles phonon calculations to study... Spin-phonon coupling is important in chromate spinel oxides ACr_(2)O_(4),but its role in LiFeCr_(4)O_(8)is not well understood.In this paper,we employ Raman scattering and first-principles phonon calculations to study this material.Ten out of 13 Raman-active modes are well assigned.Notably,no phonon splitting is observed across the structural phase transition due to the remarkably small Grüneisen constants.This observation,in conjunction with the structural data,provides compelling evidence that the structural phase transition in LiFeCr_(4)O_(8)is primarily driven by the spin-driven Jahn-Teller effect.Interestingly,some Raman modes(at 207 cm^(-1),306 cm^(-1)and 462 cm^(-1))exhibit unusual linewidth behavior across the temperature range investigated.Furthermore,the Raman spectra in different phases show no magnetic field dependence.These results suggest that phonons couple with short-range spin correlations,offering insights into how spin and lattice degrees of freedom interact in frustrated systems. 展开更多
关键词 Raman scattering phononS first-principles phonon calculations magnetic materials
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Phonon Thermal Transport at Interfaces of Graphene/Quasi-Hexagonal Phase Fullerene Heterostructure
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作者 Rui-Peng Wang Tao-Tao Yu +4 位作者 Muhammad Asif Shakoori Ming-JunHan Yu-Xiao Hu Ho-Kin Tang Hai-Peng Li 《Chinese Physics Letters》 2025年第4期67-72,共6页
In this study,we employed molecular dynamics simulations to investigate the interfacial thermal conductance(ITC)and phonon transport of heterostructures composed of graphene(GE)and quasi-hexagonal phase fullerene(qHPC... In this study,we employed molecular dynamics simulations to investigate the interfacial thermal conductance(ITC)and phonon transport of heterostructures composed of graphene(GE)and quasi-hexagonal phase fullerene(qHPC60).We examined the effects of size,interface interaction coefficients,and thermal equilibrium time on the ITC of the GE/qHPC60 heterostructure. 展开更多
关键词 molecular dynamics simulations GRAPHENE phonon transport quasi hexagonal phase fullerene HETEROSTRUCTURE phonon thermal transport interfacial thermal conductance interfacial thermal conductance itc
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Four-Phonon Scattering and Wave-Like Phonon Tunneling Drive Glassy Ultralow Lattice Thermal Conductivity in Cs_(2)AgInCl_(6)
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作者 Rongrong Ma Xiaoxiao Zhang +3 位作者 Shiqi Guo Mei Ge Junfeng Zhang Jiangjiang Ma 《Chinese Physics Letters》 2025年第9期214-223,共10页
Lead-free halide double perovskites(HDPs)provide a promising platform for high-performance thermoelectric due to their intrinsically ultralow lattice thermal conductivity k_(l).In this study,we comprehensively investi... Lead-free halide double perovskites(HDPs)provide a promising platform for high-performance thermoelectric due to their intrinsically ultralow lattice thermal conductivity k_(l).In this study,we comprehensively investigate the lattice dynamics of Cs_(2)AgInCl_(6)using first-principles calculations.By explicitly incorporating four-phonon scattering and wave-like phonon tunneling,we predict a k_(l)of 0.52 W·m^(-1)·K^(-1)with a remarkably weak temperature dependence(k_(l)∝T^(-0.31)),confirming the intrinsically glass-like ultralow k_(l)in Cs_(2)AgInCl_(6).Further analyses reveal that hierarchical chemical bonds,loosely bonded rattling atoms and a mixed crystalline-liquid state collectively induce strong anharmonicity manifested in flat phonon modes.These factors dominate the glass-like thermal transport component of k_(l).This work uncovers the underlying mechanisms governing the unusual thermal transport properties in lead-free HDPs and offers guiding principles for designing novel energy conversion technologies. 展开更多
关键词 lead free halide double perovskites four phonon scattering Cs AgInCl double perovskites hdps provide lattice dynamics wave phonon tunneling glassy ultralow lattice thermal conductivity ultralow lattice thermal conductivity
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Local time reversal symmetry breaking induced attenuation and localization of phonon transmission
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作者 Yu-Jia Zeng Qi-Zhuang Qu +1 位作者 Zhong-Ke Ding Wu-Xing Zhou 《Chinese Physics B》 2025年第11期62-68,共7页
Time-reversal symmetry(TRS)breaking induced dissipationless topological phonon edge modes provide an unprecedented way to manipulate phonon transport.However,the effect of TRS breaking on the transport properties of b... Time-reversal symmetry(TRS)breaking induced dissipationless topological phonon edge modes provide an unprecedented way to manipulate phonon transport.However,the effect of TRS breaking on the transport properties of bulk phonon modes is still unclear.In this work,we assess the effect of local TRS-breaking domains on the transport properties of bulk phonon modes in a two-dimensional(2D)hexagonal phononic lattice model.The results show that bulk phonon modes can be strongly scattered by local TRS breaking owing to the shift of the local phonon band gap,which results in significant suppression of phonon transmission.Moreover,we show that the aperiodic distribution of local TRS-breaking domains can induce phonon Anderson localization,and the localization length can be effectively tuned by the strength of TRS breaking.Our study suggests that TRS breaking can not only be used to construct dissipationless topological phonon edge states,but also be used to block the transmission of bulk phonon modes by carefully controlling the size and distribution of TRS-breaking domains.Such results provide a highly alternative way for manipulating energy flux at the nanoscale. 展开更多
关键词 phonon transmission time reversal symmetry phonon localization
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Concurrent generation and amplification of longitudinal and bending waves using defective phononic crystals
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作者 S.H.JO 《Applied Mathematics and Mechanics(English Edition)》 2025年第2期269-288,共20页
Defective phononic crystals(PnCs)have enabled spatial localization and quantitative amplification of elastic wave energy.Most previous research has focused on applications such as narrow-bandpass filters,ultrasonic se... Defective phononic crystals(PnCs)have enabled spatial localization and quantitative amplification of elastic wave energy.Most previous research has focused on applications such as narrow-bandpass filters,ultrasonic sensors,and piezoelectric energy harvesters,typically operating under the assumption of an external elastic wave incidence.Recently,a novel approach that uses defective PnCs as ultrasonic actuators to generate amplified waves has emerged.However,the existing studies are limited to the generation of either longitudinal or bending waves,with no research addressing the concurrent generation of both.Hence,this paper proposes a straightforward methodology for the concurrent generation and amplification of both wave types utilizing defect modes at independent defect-band frequencies.Bimorph piezoelectric elements are attached to the defect,with each element connected to independent external voltage sources.By precisely adjusting the magnitude and temporal phase differences between the voltage sources,concurrently amplified wave generation is achieved.The paper highlights the advantages of the proposed analytical model.This model is both computationally time-efficient and accurate,in comparison with the COMSOL simulation results.For instance,in case studies,the analytical model reduces the computational time from one hour to mere seconds,while maintaining acceptable error rates of 1%in peak frequencies.This concurrent wave-generation methodology opens new avenues for applications in rotating machinery fault diagnosis,structural health monitoring,and medical imaging. 展开更多
关键词 phononic crystal(PnC) defect concurrent generation piezoelectric ultrasonic actuator
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Giant enhancement of negative friction by resonant coupling between localized surface phonon polaritons and graphene plasmonics
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作者 Kaipeng Liu Shuai Zhou +1 位作者 Shiwei Dai Lixin Ge 《Chinese Physics B》 2025年第1期324-329,共6页
Negative friction refers to a frictional force that acts in the same direction as the motion of an object, which has been predicted in terahertz(THz) gain systems [Phys. Rev. B 108 045406(2023)]. In this work, we inve... Negative friction refers to a frictional force that acts in the same direction as the motion of an object, which has been predicted in terahertz(THz) gain systems [Phys. Rev. B 108 045406(2023)]. In this work, we investigate the enhancement of the negative friction experienced by nanospheres placed near a graphene substrate. We find that the magnitude of negative friction is related to the resonant coupling between the surface plasmon polaritons(SPPs) of the graphene and localized surface phonon polaritons(LSPh P) of nanospheres. We exam nanospheres consisted of several different materials, including SiO_(2), Si C, Zn Se, Na Cl, ln Sb. Our results suggest that the LSPh P of Na Cl nanospheres match effectively with the amplified SPPs of graphene sheets. The negative friction for Na Cl nanospheres can be enhanced about one-to-two orders of magnitude compared to that of silica(SiO_(2)) nanospheres. At the resonant peak of negative friction, the required quasi-Fermi energy of graphene is lower for Na Cl nanospheres. Our finds hold great prospects for the mechanical manipulations of nanoscale particles. 展开更多
关键词 quantum friction surface phonon polaritons surface plasmon polaritons GRAPHENE
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Electron Microscopy and Spectroscopy Investigation of Atomic, Electronic, and Phonon Structures of NdNiO_(2)/SrTiO_(3) Interface
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作者 Yuan Yin Mei Wu +9 位作者 Xiang Ding Peiyi He Qize Li Xiaowen Zhang Ruixue Zhu Ruilin Mao Xiaoyue Gao Ruochen Shi Liang Qiao Peng Gao 《Chinese Physics Letters》 2025年第4期130-141,共12页
The infinite-layer nickelates,proposed as analogs to superconducting cuprates,provide a promising platform for exploring the mechanisms of unconventional superconductivity.However,the superconductivity has been exclus... The infinite-layer nickelates,proposed as analogs to superconducting cuprates,provide a promising platform for exploring the mechanisms of unconventional superconductivity.However,the superconductivity has been exclusively observed in thin films under atmospheric pressure,underscoring the critical role of the heterointerface. 展开更多
关键词 atomic structure phonon structure electron microscopy electronic structure SPECTROSCOPY NdNiO SrTiO interface thin films superconducting cupratesprovide
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Impact of Locally Resonant Phononic Crystal Plates on Noise Reduction in Automotive Mufflers
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作者 ZHANG Mengyang ZHU Congyun +1 位作者 DING Guofang HUANG Qibai 《Journal of Donghua University(English Edition)》 2025年第5期558-565,共8页
This paper presents a locally resonant phononic crystal with excellent noise reduction in the low-frequency range as a soundproofing plate in mufflers.A locally resonant phononic crystal is established,and the bandgap... This paper presents a locally resonant phononic crystal with excellent noise reduction in the low-frequency range as a soundproofing plate in mufflers.A locally resonant phononic crystal is established,and the bandgap range of the phononic crystal is analyzed by using COMSOL software.Taking the partition plate in the muffler as the object,the acoustic-solid coupling is studied to analyze the sound insulation characteristics of the locally resonant phononic crystal.A phononic crystal plate-like structure is established to analyze its noise reduction performance in the muffler.The results indicate that the locally resonant phononic crystal exhibits favorable low-frequency sound insulation performance within a bandgap range below 200 Hz.At 160 Hz,the noise reduction is 15 dB higher than that of ordinary partition plates.As the number of layers of the phononic crystal plate increases,its noise reduction effect gradually enhances,while the magnitude of the noise reduction increment tends to diminish.At 160 Hz,the single-,double-and triple-layer plates achieve peak reductions of 47,53 and 57 dB,respectively.Compared with the double-layer phononic crystal plate,the composite of the locally resonant phononic crystal plate and the steel plate has an average noise reduction of 5 dB higher.Through research and analysis of the composite locally resonant phononic crystal plates,more feasible combined structures can be provided for future muffler structural design. 展开更多
关键词 acoustic-solid coupling MUFFLER low-frequency noise reduction locally resonant phononic crystal bandgap characteristic
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Study on band gaps and defect bands in tunable phononic crystal plates with elastic foundations
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作者 HONG Jun GAO Xingyu +1 位作者 LI Ke WANG Shaopeng 《Journal of Southeast University(English Edition)》 2025年第2期164-170,共7页
To analyze the band gap characteristics of phononic crystals,a two-dimensional phononic crystal plate model with an elastic foundation was first established.The plane wave expansion method was used to compute the disp... To analyze the band gap characteristics of phononic crystals,a two-dimensional phononic crystal plate model with an elastic foundation was first established.The plane wave expansion method was used to compute the dispersion curves of this phononic crystal model,and the results were compared with those from the finite element method to verify their accuracy.Subsequently,a parameter study explored the effects of the elastic foundation coeffi-cient and coverage ratio on the band gap.The results indicate that as the coverage ratio of the elastic foundation increases,the band gap significantly expands,reaching its maximum value at 100%coverage.Additionally,as the elastic foundation stiffness increases,the band gap gradually widens and converges toward fixed boundary conditions.The study also investigated the band gap of phononic crystal plates with defects,finding that the vibrational energy concentrates at the defect unit cell.Furthermore,the defect band frequency can be effectively modulated by adjusting the coefficient of the elastic foundation,providing a theoretical basis for achieving efficient energy conversion. 展开更多
关键词 phononic crystals elastic foundation band gap plane wave expansion method defect band
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Topology-optimized 2D silicon–air phononic crystal slabs for enhancing quality factor of laterally vibrating resonators
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作者 Zihao Xie Yongqing Fu Jin Xie 《Nanotechnology and Precision Engineering》 2025年第1期36-44,共9页
Two-dimensional phononic crystal(PnC)slabs have shown advantages in enhancing the quality factors Q of piezoelectric laterally vibrating resonators(LVRs)through topology optimization.However,the narrow geometries of m... Two-dimensional phononic crystal(PnC)slabs have shown advantages in enhancing the quality factors Q of piezoelectric laterally vibrating resonators(LVRs)through topology optimization.However,the narrow geometries of most topology-optimized silicon–air 2D PnC slabs face significant fabrication challenges owing to restricted etching precision,and the anisotropic nature of silicon is frequently overlooked.To address these issues,this study employs the finite element method with appropriate discretization numbers and the genetic algorithm to optimize the structures and geometries of 2D silicon–air PnC slabs.The optimized square-lattice PnC slabs,featuring a rounded-cross structure oriented along the`110e directions of silicon,achieve an impressive relative bandgap(RBG)width of 82.2%for in-plane modes.When further tilted by 15° from the (100) directions within the(001)plane,the optimal RBG width is expanded to 91.4%.We fabricate and characterize thin-film piezoelectric-on-silicon LVRs,with or without optimized 2D PnC slabs.The presence of PnC slabs around anchors increases the series and parallel quality factors Q_(s) and Q_(p) from 2240 to 7118 and from 2237 to 7501,respectively,with the PnC slabs oriented along the`110e directions of silicon. 展开更多
关键词 Laterally vibrating resonators phononic crystal slabs Topology optimization Quality factor
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Enhanced phonon transmission at thin-film Si on diamond interface via microtransfer printing
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作者 Yang He Shun Wan +7 位作者 Yinfei Xie Shi Zhou Xiaonan Wang Weiye Liu Yongwei Chang Yan Zhou Lifa Zhang Huarui Sun 《Nano Research》 2025年第11期1276-1285,共10页
The superior radiation tolerance of silicon-on-insulator(SOI)wafers makes them critical for next-generation integrated circuit and micro-electro-mechanical system electronics in space technology and nuclear energy,and... The superior radiation tolerance of silicon-on-insulator(SOI)wafers makes them critical for next-generation integrated circuit and micro-electro-mechanical system electronics in space technology and nuclear energy,and yet the inherently low thermal conductivity buried oxide layer severely impedes thermal management in SOI-based radio frequency/power devices.While diamond offers exceptional thermal conductivity to enhance heat dissipation,its significant thermomechanical mismatch with silicon poses major challenges to reliable hetero-integration.Here we demonstrate a novel silicon film-on-diamond(SOD)heterostructure using microtransfer printing(μTP)technology,with comparative analysis against surface activated bonded silicon-on-silicon carbide(SOC)and conventional SOI wafers.TheμTP-SOD samples exhibit near-zero residual stress(0.026 GPa)in the transferred Si layer and substantially reduced interfacial thermal resistance(ITR)compared to conventional SOI and SOC wafers.Integrated analysis of interfacial microstructures and molecular dynamics simulations reveals how interfacial structures and amorphous compositions govern the phonon thermal transport.Particularly,the amorphous SiO-SiC transition layer enhances phonon transmission at theμTP-SOD heterointerface to achieve a low ITR of 6.3+1.6/-1.5 m^(2)·K/GW.Finite element analysis verifies that these interfacial enhancements,combined with the diamond’s exceptional thermal conductivity,reduce the device junction-temperature rise by 66.7%relative to SOI devices at 15 W/mm output power.The low residual stress and reduced ITR ofμTP-SOD are expected to provide promising thermal management schemes for SOI-based electronics. 展开更多
关键词 silicon on diamond interfacial thermal resistance microtransfer printing phonon transmission device thermal management
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Conformational Order of Spacer Cations Dictates Coherent Phonon Oscillations in Two-Dimensional Organic‒Inorganic Perovskites
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作者 Jing Lai Wenyu Lv +1 位作者 Junjun Tan Shuji Ye 《Chinese Journal of Chemical Physics》 2025年第5期625-633,I0080-I0091,I0148,共22页
Phonon coherence can reflect electron‒phonon coupling information and has been proven to modulate electronic states and charge transport.The manipulation of phonon coherence through spacer cation engineering in organi... Phonon coherence can reflect electron‒phonon coupling information and has been proven to modulate electronic states and charge transport.The manipulation of phonon coherence through spacer cation engineering in organic‒inorganic hybrid perovskites(OIHPs)has been extensively demonstrated;however,the underlying structural origin remains elusive at the molecular level.Herein,we present molecular structure and temperature-dependent coherent phonon studies via a combination of sum frequency generation vibrational spectroscopy(SFG-VS)and transient absorption spectroscopy(TAS).The conformational order of spacer cations dictates the coherent phonon oscillations in 2D OIHPs.Our study further analyzes the static order and dynamic disorder in 2D perovskites.This work provides molecular-level insights into the role of spacer cations in tuning structural order and may provide valuable guidance for advancing emergent optoelecltronics development. 展开更多
关键词 Organic-inorganic hybrid perovskites Spacer cations Sum frequency generation vibrational spectroscopy Coherent phonon Structural order
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Finite-size effects on phonon-mediated thermal transport across Si-Ge interfaces:Spectral analysis and parameter optimization for molecular dynamics simulations
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作者 Zhicong Wei Haoqiang Li +4 位作者 Jianlian Huang Weikuang Li Yijuan Li Yajuan Cheng Shiyun Xiong 《Chinese Physics B》 2025年第11期54-60,共7页
The interfacial thermal resistance(ITR)at material interfaces has emerged as a critical factor in the thermal management of micro/nanoelectronic devices and composite materials.Using non-equilibrium molecular dynamics... The interfacial thermal resistance(ITR)at material interfaces has emerged as a critical factor in the thermal management of micro/nanoelectronic devices and composite materials.Using non-equilibrium molecular dynamics simulations,we systematically investigate how simulation parameters affect the calculated ITR in Si/Ge heterojunctions.Our results demonstrate that the ITR decreases with increasing system length L_(sys)and thermal bath length L_(bath).We identify linear relationships between ITR and the inverse of both L_(sys)and L_(bath),enabling reliable extrapolation to infinite-system values.While the thermostat coupling constantτshows a negligible influence on ITR,excessively large values(τ>5 ps)compromise temperature control accuracy.Spectral analysis reveals that these size effects primarily originate from mid-to-low-frequency phonons(<6 THz),whose long mean free paths make their transport particularly sensitive to system dimensions.This work establishes fundamental guidelines for parameter selection in interfacial thermal transport simulations,while providing new insights into phonon-interface interactions.The findings offer valuable implications for thermal design in high-power devices and composite materials,where accurate ITR prediction is crucial for performance optimization. 展开更多
关键词 non-equilibrium molecular dynamics phononS interfacial thermal resistance
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Bonding Hierarchy and Phonon Coherence Enhanced Ultralow Lattice Thermal Conductivity and Excellent Thermoelectric Properties in Cs_(2)TeI_(6)
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作者 Jing-Jing Zheng Chao-jun Li +2 位作者 Rong-Rong Ma Bao-Tian Wang Jiang-Jiang Ma 《Chinese Physics Letters》 2025年第8期154-167,共14页
Lead-free halide perovskites provide a promising solution for efficient thermoelectric materials due to their ultralow lattice thermal conductivity(κ_(L)).However,disadvantages such as the electrically resistive natu... Lead-free halide perovskites provide a promising solution for efficient thermoelectric materials due to their ultralow lattice thermal conductivity(κ_(L)).However,disadvantages such as the electrically resistive nature strongly affect their power factor.In this work,we introduced the Te-based halide perovskites thermoelectric material Cs_(2)TeI_(6),which is already known as a promising candidate for photovoltaic applications due to its moderate band gap.Our findings reveal that Cs_(2)TeI_(6)has an exceptionally ultralow κ_(L)at room temperature,reaching as low as 0.17 W·m^(-1)·K^(-1).We found that the four-phonon scattering processes play a dominant role in suppressing the thermal transport,leading to an approximate 50% reduction in its particle-like thermal conductivity κ_(p) at 300 K.The ultralow κ_(L)can be mainly attributed to the strong discrepancy in bonding strength,which induces large anharmonicity.The flat and dense phonon dispersions result in a strong phonon scattering rate,making it easy to generate wavelike phonon tunneling.After accounting for the wavelike thermal conductivity κ_(c),a nonstandard T^(-0.30)temperature dependence was observed.Benefiting from the ultralow κ_(L),n-type Cs_(2)TeI_(6)is predicted to achieve an extraordinary ZT of 2.26 at 700 K.This work highlights a pathway for searching high-performance and low-cost thermoelectrics based on lead-free halide perovskites. 展开更多
关键词 ultralow lattice thermal conductivity cs tei bonding hierarchy thermoelectric properties photovoltaic applications halide perovskites phonon coherence moderate band gapour
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Chiral phonons of honeycomb-type bilayer Wigner crystals
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作者 Dingrui Yang Lingyi Li +1 位作者 Na Zhang Hongyi Yu 《Chinese Physics B》 2025年第1期20-27,共8页
We theoretically investigated the chiral phonons of honeycomb-type bilayer Wigner crystals recently discovered in van der Waals structures of layered transition metal dichalcogenides. These chiral phonons can emerge u... We theoretically investigated the chiral phonons of honeycomb-type bilayer Wigner crystals recently discovered in van der Waals structures of layered transition metal dichalcogenides. These chiral phonons can emerge under the inversion symmetry breaking introduced by an effective mass imbalance between the two layers or a moiré potential in one layer, as well as under the time-reversal symmetry breaking realized by applying a magnetic field. Considering the wide tunability of layered materials, the frequencies and chirality of phonons can both be tuned by varying the system parameters. These findings suggest that bilayer honeycomb-type Wigner crystals can serve as an exciting new platform for studying chiral phonons. 展开更多
关键词 chiral phonon bilayer Wigner crystal transition metal dichalcogenides moir´e pattern
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Dispersion,attenuation,and bandgap of in-plane coupled Bloch waves in piezoelectric semiconductor phononic crystal with PN junction
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作者 Zibo WEI Peijun WEI +1 位作者 Chunyu XU Xiao GUO 《Applied Mathematics and Mechanics(English Edition)》 2025年第5期813-830,共18页
In this paper,the dispersion,attenuation,and bandgap characteristics of in-plane coupled Bloch waves in one-dimensional piezoelectric semiconductor(PSC)phononic crystals are investigated,emphasizing the influence of p... In this paper,the dispersion,attenuation,and bandgap characteristics of in-plane coupled Bloch waves in one-dimensional piezoelectric semiconductor(PSC)phononic crystals are investigated,emphasizing the influence of positive-negative(PN)junctions.Unlike piezoelectric phononic crystals,the coupled Bloch waves in PSC phononic crystals are attenuated due to their semiconductor properties,and thus the solution of Bloch waves becomes more complicated.The transfer matrix of the phononic crystal unit cell is obtained using the state transfer equation.By applying the Bloch theorem for periodic structures,the dispersion relation of the coupled Bloch waves is derived,and the dispersion,attenuation,and bandgap are obtained in the complex wave number domain.It is found that the influence of the PN junction cannot be neglected.Moreover,the effects of the PN junction under different apparent wave numbers and steady-state carrier concentrations are provided.This indicates the feasibility of adjusting the propagation characteristics of Bloch waves through the regulation of the PN heterojunction. 展开更多
关键词 piezoelectric semiconductor(PSC) phononic crystal positive-negative(PN)junction dispersion and attenuation carrier field transfer matrix
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