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Rajeev, H. S.*; Hu, X.*; Chen, W.-L.*; Zhang, D.*; Chen, T.*; 古府 麻衣子*; 梶本 亮一; 中村 充孝; Chen, A. Z.*; Johnson, G. C.*; et al.
Journal of the Physical Society of Japan, 94(3), p.034602_1 - 034602_14, 2025/03
Two-dimensional hybrid organic-inorganic perovskites (HOIPs) have emerged as promising materials for light-emitting diode applications. In this study, by using time-of-flight neutron spectroscopy we identified and quantitatively separated the lattice vibrational and molecular rotational dynamics of two perovskites, butylammonium lead iodide (BA)
PbI
and phenethyl-ammonium lead iodide (PEA)PbI. By examining the corresponding temperature dependence, we found that the lattice vibrations, as evidenced by neutron spectra, are consistent with the lattice dynamics obtained from Raman scattering. We revealed that the rotational dynamics of organic molecules in these materials tend to suppress their photoluminescence quantum yield (PLQY) while the vibrational dynamics did not show predominant correlations with the same. Additionally, we observed photoluminescence emission peak splitting for both systems, which becomes prominent above certain critical temperatures where the suppression of PLQY begins. This study suggests that the rotational motions of polarized molecules may lead to a reduction in exciton binding energy or the breaking of degeneracy in exciton binding energy levels, enhancing non-radiative recombination rates, and consequently reducing photoluminescence yield. These findings offer a deeper understanding of fundamental interactions in 2D HOIPs and could guide the design of more efficient light-emitting materials for advanced technological applications.
Liu, P.-F.*; Li, X.*; Li, J.*; Zhu, J.*; Tong, Z.*; 古府 麻衣子*; 楡井 真実; Xu, J.*; Yin, W.*; Wang, F.*; et al.
National Science Review, 11(12), p.nwae216_1 - nwae216_10, 2024/12
被引用回数：7 パーセンタイル：88.60(Multidisciplinary Sciences)Crystalline solids exhibiting inherently low lattice thermal conductivity (
) are of great importance in applications such as thermoelectrics and thermal barrier coatings. However, cannot be arbitrarily low and is limited by the minimum thermal conductivity related to phonon dispersions. In this work, we report the liquid-like thermal transport in a well-ordered crystalline CsAg
Te
, which exhibits an extremely low value of 
0.18 Wm
K. On the basis of first-principles calculations and inelastic neutron scattering measurements, we find that there are lots of low-lying optical phonon modes at 3.1 meV hosting the avoided-crossing behavior with acoustic phonons. These strongly localized modes are accompanied by weakly bound rattling Ag atoms with thermally induced large amplitudes of vibrations. Using the two-channel model, we demonstrate that coupling of the particle-like phonon modes and the heat-carrying wave-like phonons is essential for understanding the low , which is heavily deviated from the 
temperature dependence of the standard Peierls theory. In addition, our analysis indicates that the soft structural framework with liquid-like motions of the fluctuating Ag atoms is the underlying cause that leads to the suppression of the heat conduction in CsAgTe. These factors synergistically account for the ultralow value. Our results demonstrate that the liquid-like heat transfer could indeed exist in a well-ordered crystal.
Zhu, M.*; Romerio, V.*; Steiger, N.*; Nabi, S. D.*; 村井 直樹; 河村 聖子; Povarov, K. Y.*; Skourski, Y.*; Sibille, R.*; Keller, L.*; et al.
Physical Review Letters, 133(18), p.186704_1 - 186704_6, 2024/11
被引用回数：3 パーセンタイル：58.36(Physics, Multidisciplinary)Magnetic, thermodynamic, neutron diffraction and inelastic neutron scattering are used to study spin correlations in the easy-axis XXZ triangular lattice magnet KCo(SeO
). Despite the presence of quasi-2D supersolid magnetic order, the low-energy excitation spectrum contains no sharp modes and is instead a broad and structured multiparticle continuum. Applying a weak magnetic field drives the system into an m = 1/3 fractional magnetization plateau phase and restores sharp spin wave modes. To some extent, the behavior at zero field can be understood in terms of spin wave decay. However, the presence of clear excitation minima at the M points of the Brillouin zone suggest that the spinon language may provide a more adequate description, and signals a possible proximity to a Dirac spin liquid state.
-
transitionsYang, Q.*; Yang, X.*; Wang, Y.*; Fei, Y.*; Li, F.*; Zheng, H.*; Li, K.*; Han, Y.*; 服部 高典; Zhu, P.*; et al.
Nature Communications (Internet), 15, p.7778_1 - 7778_9, 2024/09
被引用回数：6 パーセンタイル：84.39(Multidisciplinary Sciences)明るい一重項励起子と三重項励起子を同時に発現する発光材料は、オプトエレクトロニクス、サイネージ、情報暗号化において大きな可能性を秘めている。しかしながら、高性能の白色発光を実現するためには、蛍光と燐光の寄与が不均衡であることが大きな障害となっている。ここでは、水素結合の協同効果による圧力処理エンジニアリングによって、n--遷移の混合を実現し、イソフタル酸(IPA)中で三重項状態の発光を7%から40%に高めることで、この課題に対処した。加圧処理したIPAでは、蛍光と燐光のハイブリッドに基づく優れた白色発光が得られ、フォトルミネッセンス量子収率は当初の19%(青色発光)から75%に増加した。その場での高圧IRスペクトル、X線回折、中性子回折から、圧力の上昇に伴い水素結合が連続的に強化されることが明らかになった。さらに、この強化された水素結合は、圧力処理後も常圧条件下まで保持され、バランスの取れた一重項/三重項励起子集団のための効率的な系間交差を目的としたIPAに与え、効率的な白色発光をもたらした。この研究は、有機低分子の三重項状態を明るくするルートを提案するだけでなく、一重項励起子と三重項励起子の比率を調節して、高性能の白色発光を構築するものである。
Zhu, L.*; He, H.*; Naeem, M.*; Sun, X.*; Qi, J.*; Liu, P.*; Harjo, S.; 中島 健次; Li, B.*; Wang, X.-L.*
Physical Review Letters, 133(12), p.126701_1 - 126701_6, 2024/09
被引用回数：1 パーセンタイル：58.36(Physics, Multidisciplinary)It has long been suspected that magnetism could play a vital role in the phase stability of multi- component high-entropy alloys. However, the nature of the magnetic order, if any, has remained elusive. Here, by using elastic and inelastic neutron scattering, we demonstrate evidence of antiferromagnetic order below 80 K and strong spin fluctuations persisting to room temperature in a single-phase face-centered cubic (fcc) CrMnFeCoNi high-entropy alloy. Despite the chemical complexity, the magnetic structure in CrMnFeCoNi can be described as 
-Mn-like, with the magnetic moments confined in alternating (001) planes and pointing toward the 
111
direction. Combined with first-principles calculation results, it is shown that the antiferromagnetic order and spin fluctuations help stabilized the fcc phase in CrMnFeCoNi high-entropy alloy.
Ying, H.*; Yang, X.*; He, H.*; Yan, A.*; An, K.*; Ke, Y.*; Wu, Z.*; Tang, S.*; Zhang, Z.*; Dong, H.*; et al.
Scripta Materialia, 250, p.116181_1 - 116181_7, 2024/09
被引用回数：1 パーセンタイル：54.79(Nanoscience & Nanotechnology)Nanoscale chemical fluctuations and their effect on the deformation behavior of CrFeCoNi-based high-entropy alloys (HEAs) were investigated using small-angle scattering and in situ neutron diffraction measurements. Small-angle scattering results demonstrated the presence of nano (
10 nm) chemical fluctuations in the as-prepared CrFeCoNiPd HEAs, which was attributed to the negative mixing of enthalpy and the significant atomic radius difference between Pd and the constituent elements in the CrFeCoNi-based alloys. Subsequent tensile tests demonstrated that the yield and tensile strengths of the as-prepared CrFeCoNiPd HEA surpass those of the as-prepared CrMnFeCoNi HEA. Neutron diffraction data analysis revealed an anomalous response of dislocation evolution with the strain.
Hu, F. F.*; Qin, T. Y.*; Ao, N.*; Su, Y. H.; Zhou, L.*; 徐 平光; Parker, J. D.*; 篠原 武尚; Chen, J.*; Wu, S. C.*
Engineering Fracture Mechanics, 306, p.110267_1 - 110267_18, 2024/08
被引用回数：2 パーセンタイル：51.41(Mechanics)Non-destructive and quantitative mapping of gradient residual strain distribution in surface-hardened railway S38C axles could provide a positive reference for determining service lifetime and maintenance strategy. To tackle this concern, time-of-flight neutron Bragg-edge transmission imaging was employed by real axle samples with and without impacted crater. A novel and simple procedure to formulate the residual strain field was also developed in this work, with the transmission batch code in Appendix A. By mapping the global two- dimensional residual strains, it can be verified that the residual strains into the axle are uniformly distributed in the hoop direction. Subsequently, it was revealed that the axial and hoop residual strains, respectively in the cylinder and the long strip samples prepared from a real S38C hollow axle, indicated a gradient evolution distribution with a depth of 8 mm, covering a range of -5500 1000 
for axial strains and -6500 1000 for hoop strains. More importantly, the maximum compressive lattice strain of the cylinder sample was increased by 15.61%, and 22.35% at the impacting speeds of 100, and 125 m/s, respectively; and that of the long strip sample increased by 29.17%, and 43.70%, respectively. It can thus be concluded that lattice strains have redistributed around the impact crater, demonstrating the local alteration of the residual strain field. These new findings suggest the localized variation in residual strains should be taken into account while evaluating the service damage evolution of railway axles, especially those affected by high-speed impacts during operation.
Qin, T. Y.*; Hu, F. F.*; 徐 平光; Zhang, H.*; Zhou, L.*; Ao, N.*; Su, Y. H.; 菖蒲 敬久; Wu, S. C.*
International Journal of Fatigue, 185, p.108336_1 - 108336_13, 2024/08
被引用回数：8 パーセンタイル：92.28(Engineering, Mechanical)Gradient distribution of triaxial residual stresses to a depth of several millimeters is retained in middle carbon steel S38C axles after high-frequency induction hardening, which has become a critical concern for fatigue structural integrity. To address this, the axial, hoop, and radial gradient residual strains inside the axles were measured for the first time by advanced neutron diffraction. The SIGINI Fortran subroutine was then adopted to reconstruct the global initial residual stress field from the measured data. Experimental and simulation results show that residual stresses of about -520 MPa (axial), -710 MPa (hoop), and -40 MPa (radial) residual stress were retained below the axle surface. Subsequently, the fatigue crack propagation behavior of S38C axles was numerically investigated in the framework of fracture mechanics. The calculated results clearly show that the compressive residual stresses at a depth of 0?3 mm from the axle surface lead to a low crack growth driving force, and that fatigue cracks do not propagate as long as the crack depth is less than 3.7 mm for hollow S38C axles. These results further indicate that the maximum defect size allowed in routine inspections is acceptable from a safety and economic point of view. Accurate measurement and characterization of the global gradient residual stress field through experiments and simulations can provide an important reference for optimizing the mileage intervals of nondestructive testing (NDT) of surface defects in these surface-strengthened railway axles.
Zhou, L.*; Zhang, H.*; Qin, T. Y.*; Hu, F. F.*; 徐 平光; Ao, N.*; Su, Y. H.; He, L. H.*; Li, X. H.*; Zhang, J. R.*; et al.
Metallurgical and Materials Transactions A, 55(7), p.2175 - 2185, 2024/07
被引用回数：3 パーセンタイル：82.75(Materials Science, Multidisciplinary)High-speed railway S38C axles undergo surface induction hardening for durability, but are susceptible to fatigue cracks from foreign object impact. The neutron diffraction method was employed to measure the residual strain in S38C axles, obtaining microscopic lattice distortion data, for the gradient layer at a depth of 8 mm under the surface. The results showed that after induction-hardening, the microscopic lattice distortion had a gradient distribution, decreasing with the distance from the surface. However, in the case of impacting speed of 600 km/m, the average microscopic lattice distortion increased with the distance from the surface, reaching a maximum augmentation of 55 pct. These findings indicate a strong experimental basis, and improve our understanding of the relationship between macroscopic residual stress and decision-making, in regard to operation and maintenance.
Ma, Y.*; Naeem, M.*; Zhu, L.*; He, H.*; Sun, X.*; Yang, Z.*; He, F.*; Harjo, S.; 川崎 卓郎; Wang, X.-L.*
Acta Materialia, 270, p.119822_1 - 119822_13, 2024/05
被引用回数：7 パーセンタイル：91.87(Materials Science, Multidisciplinary)We report an in situ neutron diffraction study of 316 L that reveals an extraordinary work-hardening rate (WHR) of 7 GPa at 15 K. Detailed analyses show that the major contribution to the excellent strength and ductility comes from the transformation-induced plasticity (TRIP) effect, introduced by the austenite-to-martensite (-to-
') phase transition. A dramatic increase in the WHR is observed along with the transformation; the WHR declined when the austenite phase is exhausted. During plastic deformation, the volume-fraction weighted phase stress and stress contribution from the '-martensite increase significantly. The neutron diffraction data further suggest that the -to-' phase transformation was mediated by the -martensite, as evidenced by the concurrent decline of the phase with the phase.
Cl via 
and 
decayTripathi, V.*; Bhattacharya, S.*; Rubino, E.*; Benetti, C.*; Perello, J. F.*; Tabor, S. L.*; Liddick, S. N.*; Bender, P. C.*; Carpenter, M. P.*; Carroll, J. J.*; et al.
Physical Review C, 109(4), p.044320_1 - 044320_15, 2024/04
被引用回数：0 パーセンタイル：0.00(Physics, Nuclear)ミシガン州立大学の国立超伝導サイクロトロン研究所において
Caのフラグメンテーション反応によって中性子過剰核
Sを生成し、そこからのベータ崩壊および遅発中性子放出ベータ崩壊によってClの励起状態を得た。得られた実験データをSDPFSDG-MU相互作用を用いた大規模殻模型計算と比較し、よい一致を得た。
Li, X.*; Zhu, R.*; Xin, J.*; Luo, M.*; Shang, S.-L.*; Liu, Z.-K.*; Yin, C.*; 舟越 賢一*; Dippenaar, R. J.*; 肥後 祐司*; et al.
CALPHAD; Computer Coupling of Phase Diagrams and Thermochemistry, 84, p.102641_1 - 102641_6, 2024/03
被引用回数：0 パーセンタイル：0.00(Thermodynamics)The phase transformations and pressure-volume dependencies of the Ti-45Al alloy with respect to pressure have been investigated by means of in-situ observation using multi anvil-type high-pressure devices and synchrotron radiation. Under hydrostatic compression from 0 to 10.1 GPa, about 2.3 vol. % of transforms continuously to 2. Lattice parameters as well as volume fractions of these two phases have been determined as a function of pressure. Bulk moduli estimated using Birch-Murnaghan's equation of state are 148 GPa for the phase, 138 GPa for the 2 phase, and 149 GPa for their two-phase mixture of Ti-45Al alloy. First-principles have also applied to investigate bulk moduli of two single phases, and the deviation between calculations and measurements is discussed and attributed to mainly phase transformation. The presently study provides useful insights into thermodynamics of 2 and phases under high pressure.
Linh, B. D.*; Corsi, A.*; Gillibert, A.*; Obertelli, A.*; Doornenbal, P.*; Barbieri, C.*; Duguet, T.*; G
mez-Ramos, M.*; Holt, J. D.*; Hu, B. S.*; et al.
Physical Review C, 109(3), p.034312_1 - 034312_15, 2024/03
被引用回数：1 パーセンタイル：68.69(Physics, Nuclear)理化学研究所RIビームファクトリーにて中性子過剰核
Arビームからの1中性子ノックアウト反応実験を行い、
Arのエネルギー準位および分光学的因子を導出した。特に、第一励起状態の
への分光学的因子が大きいことから、始状態のArの基底状態において中性子が
軌道を多く占めていることがわかった。これは、中性子数32がよい魔法数として知られる
Caとは異なった性質であり、カルシウムからアルゴンへと陽子が2個減ることで閉殻構造が大きく崩れることが明らかになった。
Be analysis of the rock samples from the northeastern shore of Lake Pumoyum Co in south Tibetan Plateau奈良 郁子*; 渡邊 隆広; 國分 陽子; Zhu, L.*
Nuclear Instruments and Methods in Physics Research B, 539, p.28 - 32, 2023/06
被引用回数：0 パーセンタイル：0.00(Instruments & Instrumentation)チベット高原はその広大な面積、及び地形学的な特徴から、地球規模の気候変動及び物質循環に対して重要な役割を果たしている。現在のチベット高原南部における降水量の変動は、特に南西からのインドモンスーンによる影響を受けることが知られている。したがって、この地域の降水量変動を復元することにより、アジアにおける過去のモンスーン活動の変動に関する情報が得られると期待される。チベット高原南部の標高約5,030mに位置するプマユムツォ湖は世界で最も高所に存在する湖の一つである。これまでにプマユムツォ湖の湖底堆積物を用いて過去の湖水面変動や環境変動の推測に関する研究が行われてきた。本研究では湖の北東側の湖岸から岩石試料を採取し、岩石中で生成する宇宙線生成核種であるBe等の測定を実施することで、湖水面変動に伴う岩石の露出年代の推定を試みた。プマユムツォ湖湖岸の岩石中のBe濃度は、3.78-10.8
10
(atoms/g)の範囲を示した。仮に岩石中のBe濃度が、湖水面変動に影響されているとすれば、Be濃度は湖から離れるに従い増加するはずである。しかし、プマユムツォ湖湖岸の岩石中のBe濃度の分布は、湖から離れるに従って減少する傾向を示した。したがって、プマユムツォ湖の湖岸段丘から採取された岩石中のBe濃度の分布は、岩石の露出年代よりも、侵食速度もしくはテクトニックな変動に影響されている可能性が高いと考えられる。
Meng, L.*; Wang, B.*; Wang, G.-J.*; Zhu, S.-L.*
Physics Reports; A Review Section of Physics Letters, 1019, p.1 - 149, 2023/05
被引用回数：110 パーセンタイル：97.91(Physics, Multidisciplinary)Chiral symmetry and its spontaneous breaking play an important role both in the light hadron and heavy hadron systems. The chiral perturbation theory (
PT) is the low energy effective field theory of the Quantum Chromodynamics. In this work, we shall review the investigations on the chiral corrections to the properties of the heavy mesons and baryons within the framework of PT. We will also review the scatterings of the light pseudoscalar mesons and heavy hadrons, through which many new resonances such as the D*s0(2317) could be understood. Moreover, many new hadron states were observed experimentally in the past decades. A large group of these states is near-threshold resonances, such as the charged charmoniumlike 
and 
states, bottomoniumlike 
states, hidden-charm pentaquark 
and 
states and the doubly charmed 
state, etc. They are very good candidates of the loosely bound molecular states composed of a pair of charmed (bottom) hadrons, which are very similar to the loosely bound deuteron. The modern nuclear force was built upon the chiral effective field theory (LEFT), which is the extension of the PT to the systems with two matter fields. The long-range and medium-long-range interactions between two nucleons arise from the single-and double-pion exchange respectively, which are well constrained by the chiral symmetry and its spontaneous breaking. The short-distance interactions can be described by the low energy constants. Such a framework works very well for the nucleon-nucleon scattering and nuclei. In this work, we will perform an extensive review of the progress on the heavy hadronic molecular states within the framework of LEFT. We shall emphasize that the same chiral dynamics not only govern the nuclei and forms the deuteron, but also dictates the shallow bound states or resonances composed of two heavy hadrons.
-wave 
states combining quark model and lattice QCD in the coupled channel frameworkYang, Z.*; Wang, G.-J.*; Wu, J.-J.*; 岡 眞; Zhu, S.-L.*
Journal of High Energy Physics (Internet), 2023(1), p.058_1 - 058_19, 2023/01
被引用回数：7 パーセンタイル：73.87(Physics, Particles & Fields)ハミルトニアン有効理論にクォーク模型、クォークペア生成、
相互作用の情報を含むベアな状態と散乱状態の結合を取り入れた形式を用いて、しきい値近傍の波の4個の状態のスペクトルを研究した。
decay of exotic P and S isotopes with neutron number near 28Tripathi, V.*; Bhattacharya, S.*; Rubino, E.*; Benetti, C.*; Perello, J. F.*; Tabor, S. L.*; Liddick, S. N.*; Bender, P. C.*; Carpenter, M. P.*; Carroll, J. J.*; et al.
Physical Review C, 106(6), p.064314_1 - 064314_14, 2022/12
被引用回数：4 パーセンタイル：56.09(Physics, Nuclear)ミシガン州立大学の国立超伝導サイクロトロン研究所にて、中性子過剰なリン、硫黄同位体を生成し、そこからのベータ崩壊半減期および娘核の励起準位を測定した。
Pの崩壊によって得られるエネルギー準位から、この原子核の基底状態は
あるいは
であることが示唆された。中性子数が偶数の硫黄同位体からの崩壊様式を系統的に調べた結果、中性子数が増えるにつれてガモフテラー遷移強度の大きな準位の励起エネルギーが高くなることがわかった。これは、大規模殻模型計算によって予言されている現象に一致する。
statesYang, Z.*; Wang, G.-J.*; Wu, J.-J.*; 岡 眞; Zhu, S.-L.*
Physical Review Letters, 128(11), p.112001_1 - 112001_6, 2022/03
被引用回数：33 パーセンタイル：95.31(Physics, Multidisciplinary)閾値近傍のハドロン共鳴を有限サイズの格子QCDのデータを用いて解析する新しい手法を提案し、正パリティのメソンのスペクトルに応用した。ハミルトニアン有効理論にクォーク模型,クォークペア生成,DK相互作用の情報を入れてベアな状態と散乱状態の結合を取り入れた。4個の状態のうち、
と
の状態は散乱状態と強く混合する。一方で、と
はほとんどベアなクォーク模型状態で記述できる。有限格子サイズでのレベル交差が再現されることを示した。
(3872)Meng, L.*; Wang, G.-J.*; Wang, B.*; Zhu, S.-L.*
Physical Review D, 104(9), p.094003_1 - 094003_8, 2021/11
被引用回数：27 パーセンタイル：84.79(Astronomy & Astrophysics)
共鳴のアイソスピンを破る崩壊について再解析を行った。その結果の内部構造と崩壊におけるアイソスピンの破れを定量的に結びつける新しい解析方法を提案し、これを適用した。その結果、における中性メソンチャネルの寄与が80%であることがわかった。
BiDoherty, D. T.*; Andreyev, A. N.; Seweryniak, D.*; Woods, P. J.*; Carpenter, M. P.*; Auranen, K.*; Ayangeakaa, A. D.*; Back, B. B.*; Bottoni, S.*; Canete, L.*; et al.
Physical Review Letters, 127(20), p.202501_1 - 202501_6, 2021/11
被引用回数：10 パーセンタイル：66.16(Physics, Multidisciplinary)Bi is the heaviest known proton emitting isotope. Its decay had been observed, but the assumed ground-state lifetime (
s) was incorrect, leading to unexplained hindrance. With two new experiments at Argonne National Laboratory, two states were clearly identified. One is the proton-emitting ground-state (spin 1/2
, half-life: 2.8
s), the second is a 58(2) s -decaying isomer. The new data show the inversion of the ground and isomeric states compared to neighboring Bi isotopes. This is the only known example of a ground-state proton decay to a daughter nucleus (
Pb) with a major shell closure.
