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EPR at 80: Carotenoid Radical Cation Detection 80 波长的 EPR:类胡萝卜素自由基阳离子检测
IF 1.1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-08-09 DOI: 10.1007/s00723-024-01691-7
A. L. Focsan, Lowell D. Kispert
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引用次数: 0
A Proposal of Gradient Coil Configuration for Low-Field Magnetic Resonance Imaging 低场磁共振成像梯度线圈配置建议
IF 1.1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-08-09 DOI: 10.1007/s00723-024-01682-8
Alexander Fedotov, Vladimir Pugovkin, Denis Burov, Anna Hurshkainen, C. Mirabal
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引用次数: 0
Magnetic Resonance of Excited States in Semiconductors and Related Nanostructures 半导体及相关纳米结构中激发态的磁共振
IF 1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-08-06 DOI: 10.1007/s00723-024-01695-3
Pavel G. Baranov, Roman A. Babunts, Nikolai G. Romanov

Electron and nuclear spins in solids, coherently coupled to photons, provide promising resources for quantum information processing and sensing. Obtaining information about short-lived excited states is critical for realizing ultrafast all-optical spin control methods. After a brief review of early magnetic resonance studies of excited states, the following representative examples of the use of magnetic resonance spectroscopy to study excited states in wide-gap materials, semiconductors and nanostructures based on them will be considered: (1) optically detected magnetic resonance (ODMR), electron spin echo, electron-nuclear double resonance in the excited state on the example of self-trapped excitons in ionic-covalent silver halide crystals and nanocrystals, (2) ODMR and level anticrossing (LAC) spectroscopy of localized heavy-hole excitons in semiconductor quantum wells and superlattices, (3) LAC and ODMR in excited states of spin centers in diamond and silicon carbide, (4) the use of LAC and cross-relaxation for all-optical sensing with submicron spatial resolution.

固体中的电子自旋和核自旋与光子相干耦合,为量子信息处理和传感提供了前景广阔的资源。获取短寿命激发态的信息对于实现超快全光自旋控制方法至关重要。在简要回顾了早期对激发态的磁共振研究之后,我们将讨论以下利用磁共振光谱研究宽隙材料、半导体及其纳米结构中激发态的代表性实例:(1) 以离子共价卤化银晶体和纳米晶体中的自俘获激子为例,介绍激发态下的光探测磁共振(ODMR)、电子自旋回波、电子-核双共振、(2) 半导体量子阱和超晶格中局域重空穴激子的 ODMR 和电平反交叉(LAC)光谱,(3) 金刚石和碳化硅中自旋中心激发态的 LAC 和 ODMR,(4) 利用 LAC 和交叉衰减实现亚微米空间分辨率的全光传感。
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引用次数: 0
EPR Studies of Rare-Earth Manganites La0.7−xEuxSr0.3MnO3 (x = 0.1–0.7) 稀土锰矿 La0.7-xEuxSr0.3MnO3 (x = 0.1-0.7) 的 EPR 研究
IF 1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-08-06 DOI: 10.1007/s00723-024-01694-4
I. Yatsyk, D. V. Mamedov, A. V. Shestakov, I. I. Fazlizhanov, R. M. Eremina, S. I. Andronenko, A. V. Pyataev, S. Vadnala, S. Asthana, S. K. Misra

The Europium rare-earth manganites, La0.7−xEuxSr0.3MnO3 (x = 0.0–0.7), were investigated by the technique of X-band electron paramagnetic resonance (EPR) in the temperature range from 30 to 500 K. As the temperature was lowered, the various samples made transitions from paramagnetic to ferromagnetic phases. Furthermore, coexistence of anywhere from two to three ferromagnetic phases in the various samples was found. The third ferromagnetic phase was observed only in the samples with x = 0.1, 0.2, 0.3. The Curie temperatures for the various samples were estimated from the characteristics of the variable-temperature EPR spectra. The EPR data indicated the presence of Griffiths phases in the samples with x = 0.2, 0.3, 0.4, 0.5, 0.6, from which the respective Griffiths temperatures were determined. The activation energies were estimated here from the EPR data using the hopping model. The EPR linewidth behavior is found to be consistent with that predicted by the bottlenecked spin-relaxation model. The perovskite La0.5Eu0.2Sr0.3MnO3 is potentially useful in the design of magnetocaloric refrigeration units as a working fluid, since its Curie temperature TC is found to be close to the room temperature. The various ferromagnetic components in the samples observed here have been resolved only by the technique of EPR, not possible by other techniques.

利用 X 波段电子顺磁共振(EPR)技术研究了温度范围为 30 至 500 K 的铕稀土锰矿 La0.7-xEuxSr0.3MnO3(x = 0.0-0.7)。此外,在各种样品中还发现了两到三种铁磁相共存的现象。只有在 x = 0.1、0.2 和 0.3 的样品中才观察到第三种铁磁相。各种样品的居里温度是根据变温 EPR 光谱的特征估算出来的。EPR 数据表明 x = 0.2、0.3、0.4、0.5、0.6 的样品中存在格里菲斯相,并由此确定了各自的格里菲斯温度。这里的活化能是利用跳跃模型从 EPR 数据中估算出来的。发现 EPR 线宽行为与瓶颈自旋松弛模型预测的一致。由于发现过氧化物 La0.5Eu0.2Sr0.3MnO3 的居里温度 TC 接近室温,因此将其作为工作流体在磁致制冷装置的设计中具有潜在的用途。这里观察到的样品中的各种铁磁性成分只有通过 EPR 技术才能分辨出来,而其他技术则无法做到这一点。
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引用次数: 0
Study of Saturation Properties of an Inhomogeneous CW-EPR Line in the Vicinity of Rabi Resonance: Possible Application for B1 Estimation 研究拉比共振附近不均匀 CW-EPR 线的饱和特性:B1 估算的可能应用
IF 1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-08-05 DOI: 10.1007/s00723-024-01693-5
B. Rakvin, J. Jurec

The spectrum of continuous-wave electron paramagnetic resonance (CW-EPR) was analyzed with respect to the shape of the line under microwave (MW) power saturation (({P}_{MW}sim {B}_{1}^{1/2};{B}_{1}) is intensity of MW magnetic field). The used ({B}_{1}) increases until the Rabi frequency (({omega }_{1}=gamma {B}_{1}), (gamma) is the electron gyromagnetic ratio) approaches the radiofrequency (left({omega }_{rf}right)) used as the magnetic modulation frequency. The possible effect of Rabi resonance (left({omega }_{1}={omega }_{rf}right)), on spin packets system can be detected under the condition of “weak modulation near the Rabi resonance” (({omega }_{2}ll {omega }_{1}approx {omega }_{rf})) where ({omega }_{2}) is modulation amplitude of radiofrequency field expressed in frequency units. Inhomogeneously broadened, CW-EPR, lines of the P1 (Ns0) nitrogen centers (30 ppm > [Ns0] < 200 ppm) in diamond crystal and E’ defect in irradiated vitreous SiO2 with long spin relaxation times (({T}_{1}) and ({T}_{2}) ranged in the interval from around 2 ms to 1 µs at room temperatures) were selected for saturation study. Spectra were recorded using magnetic field modulation (({omega }_{rf}/2pi =100) kHz) with modulation amplitude (({omega }_{2}/2pi =27text{ kHz})) as the first harmonic for two phase-sensitive detections, detection in-phase with respect to the modulation frequency and detection 90° out-of-phase with respect of the modulation frequency. For the later detection, the resulting change near Rabi resonance can be related to the expected inversion of modulation sideband lines under resonance conditions. This effect detected in the saturation process on inhomogeneous spectral lines of P1 and E’ centers shows that both samples can be used as a standard for estimation ({B}_{1}) value.

分析了连续波电子顺磁共振(CW-EPR)光谱在微波(MW)功率饱和(({P}_{MW}sim {B}_{1}^{1/2};{B}_{1}) 是 MW 磁场强度)情况下的线形。使用的({B}_{1})增加,直到拉比频率(({omega }_{1}=gamma {B}_{1}),(gamma)是电子回旋磁比)接近作为磁调制频率的射频(left({omega }_{rf}right))。拉比共振可能产生的影响((left({omega }_{1}={omega }_{rf}right))、其中 ({omega }_{2} 是射频场的调制幅度,以频率单位表示。饱和研究选择了金刚石晶体中 P1 (Ns0) 氮中心(30 ppm > [Ns0] < 200 ppm)和辐照玻璃体二氧化硅中 E'缺陷的不均匀拓宽、CW-EPR、自旋弛豫时间较长(室温下,({T}_{1})和({T}_{2})在 2 ms 到 1 µs 之间)的线。使用磁场调制(({omega }_{rf}/2pi =100) kHz)记录频谱,调制幅度(({omega }_{2}/2pi =27text{ kHz})) 作为两个相位敏感检测的第一次谐波,相对于调制频率的同相检测和相对于调制频率的离相 90° 检测。对于后一种检测,在拉比谐振附近产生的变化与谐振条件下预期的调制边带线反转有关。在 P1 和 E'中心不均匀谱线的饱和过程中检测到的这种效应表明,这两个样本都可用作估算 ({B}_{1}) 值的标准。
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引用次数: 0
Spin Alignment of NV− Centers in 4H- and 6H-SiC Crystals Induced by IR and Visible Optical Excitation 红外和可见光激发下 4H 和 6H-SiC 晶体中 NV 中心的自旋排列
IF 1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-08-02 DOI: 10.1007/s00723-024-01690-8
F. F. Murzakhanov, D. V. Shurtakova, E. I. Oleynikova, G. V. Mamin, M. A. Sadovnikova, O. P. Kazarova, E. N. Mokhov, M. R. Gafurov, V. A. Soltamov

It is acknowledged that a solid-state foundation for qubit implementation can be found in optically active high-spin vacancy-type defects (color centers) in semiconductors. Silicon carbide (SiC) crystals serve as a reliable host for defects, positioning them as strong competitors to the well-known nitrogen vacancy ({NV}^{-}) centers in diamond. This paper reports on photoinduced electron paramagnetic resonance (W-band, 94 GHz) spectroscopy measurements on 4H and 6H polytype SiC crystals which exhibit distinct optically polarizable color centers due to their unique structural and electronic properties. Spin defects such as negatively charged nitrogen vacancy centers and divacancies excited at 532 nm, are present in 4H-SiC. By contrast, only ({NV}^{-}) centers excited at 980 nm are found in 6H-SiC across a wide temperature range. These features make the 6H-SiC color centers promising for quantum technologies because of their excitation and luminescence in the near-infrared telecommunications range, as well as their ability to selectively target the resonant excitation of individual-based qubits.

半导体中光学活性高自旋空位型缺陷(色心)被认为是实现量子比特的固态基础。碳化硅(SiC)晶体是缺陷的可靠宿主,是金刚石中著名的氮空位({NV}^{-})中心的有力竞争者。本文报告了对 4H 和 6H 多晶型碳化硅晶体进行的光诱导电子顺磁共振(W 波段,94 GHz)光谱测量结果,这些晶体因其独特的结构和电子特性而表现出不同的光学可偏振色彩中心。4H-SiC 中存在自旋缺陷,如带负电的氮空位中心和在 532 纳米波长下激发的空位。相比之下,6H-SiC 中只有在 980 纳米波长下激发的 ({NV}^{-})中心可以在很宽的温度范围内找到。这些特征使得 6H-SiC 彩色中心在量子技术中大有可为,因为它们可以在近红外电信范围内激发和发光,并且能够选择性地针对基于单个量子比特的共振激发。
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引用次数: 0
Water structure and Dynamics in Microporous Mordenite 微孔莫来石中的水结构与动力学
IF 1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-27 DOI: 10.1007/s00723-024-01692-6
Andrei V. Egorov, Maria I. Egorova, Dmitry A. Mizyulin, Marina G. Shelyapina

The local ordering and features of the molecular mobility of water confined in voids of a pure silica mordenite were studied using the molecular dynamics simulation over a temperature range from 298 to 163 K. The simulated system was a fragment of mordenite consisted of 2 × 2 × 4 unit cells filled with 384 water molecules. Three different water models: SPCE, SPCF, and TIP5P were considered. To study the effect of nanoconfinment, the results were compared with bulk water. The modeling suggests that at room temperature, a 2D (in c and b directions of the mordenite cell) water diffusion takes place, while upon cooling, the diffusion in b direction essentially slows down. The analysis of microstructure shows that the pores prevent the formation of a full tetrahedral structure of water environment that results in formation of several water substructures. A detailed analysis of water reorientational motion was carried out and the activation energies were determined from temperature dependences of the correlation times. Of the three water models considered, SPCE demonstrated the best performance. The results obtained can be helpful for interpretation of experimental temperature dependences of NMR relaxation rates for water molecules confined in porous media with complex topology.

在 298 至 163 K 的温度范围内,利用分子动力学模拟研究了封闭在纯硅莫来石空隙中的水的局部有序性和分子流动性特征。有三种不同的水模型:考虑了 SPCE、SPCF 和 TIP5P 三种不同的水模型。为了研究纳米纤化的影响,将结果与块状水进行了比较。建模结果表明,在室温下,水发生了二维(在莫氏晶胞的 c 和 b 方向)扩散,而在冷却时,b 方向的扩散基本减慢。对微观结构的分析表明,孔隙阻碍了水环境完整四面体结构的形成,从而导致了多种水亚结构的形成。对水的重新定向运动进行了详细分析,并根据相关时间的温度相关性确定了活化能。在考虑的三种水模型中,SPCE 的性能最佳。研究结果有助于解释具有复杂拓扑结构的多孔介质中水分子核磁共振弛豫速率的实验温度依赖性。
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引用次数: 0
EPR in Research of the Magnetic Properties of Spin-Crossover Fe(III) Complexes with Polydentate Schiff Bases EPR 在多价席夫碱自旋交叉铁(III)配合物磁性研究中的应用
IF 1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-26 DOI: 10.1007/s00723-024-01685-5
E. N. Frolova, O. A. Turanova, L. V. Bazan, I. V. Ovchinnikov, A. N. Turanov

Schiff bases allow the creation of compounds with a wide variety of architectures and properties and have been of interest to researchers for many years. This mini-review describes some of the possibilities of the EPR method, which we use to study Fe(III) complexes with polydentate Schiff bases, many of which have been synthesized for the first time. Obtaining information at the local level using EPR spectroscopy allows us to grasp the molecular structure–property relationship and to adjust the synthesis strategy to create multifunctional substances with predetermined properties.

希夫碱可以创造出具有多种结构和性质的化合物,多年来一直受到研究人员的关注。这篇微型综述介绍了 EPR 方法的一些可能性,我们用这种方法来研究具有多齿席夫碱的铁(III)配合物,其中许多配合物是首次合成的。利用 EPR 光谱法获取局部信息,使我们能够掌握分子结构与性质之间的关系,并调整合成策略,创造出具有预定性质的多功能物质。
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引用次数: 0
Insight into Details of Chemical Exchange Kinetics Studied by NMR CPMG Method 通过 NMR CPMG 方法研究化学交换动力学细节的启示
IF 1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-24 DOI: 10.1007/s00723-024-01679-3
Janez Stepišnik, Aleš Mohorič

A more detailed insight into the chemical kinetics and dynamics of chemical exchanges within a molecule or between molecules in liquids is made possible by the NMR CPMG method, which, in addition to the exchange rate, gives its power spectrum, which contains information about the underlying processes of chemical exchange. The applicability of the method is demonstrated by measuring the chemical exchange in an aqueous solutions of sucrose, whose rate spectra have shapes that cannot be explained as transitions in a double potential well, but after interpretation using the chemical Langevin equations, it can be explained as a cascading chemical transition across several intermediate potential walls.

NMR CPMG 方法可以更详细地了解分子内部或液体分子之间化学交换的化学动力学和动态,除了交换速率外,还能给出其功率谱,其中包含有关化学交换基本过程的信息。通过测量蔗糖水溶液中的化学交换,证明了该方法的适用性,其速率谱的形状无法解释为双势阱中的跃迁,但在使用化学朗之文方程进行解释后,可将其解释为跨越多个中间势壁的级联化学跃迁。
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引用次数: 0
Celebration of 80 Years of EPR EPR 80 周年庆典
IF 1 4区 物理与天体物理 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-24 DOI: 10.1007/s00723-024-01688-2
Kev M. Salikhov, Sandra S. Eaton, Gareth R. Eaton

We celebrate 80 years of EPR with a special issue of Applied Magnetic Resonance featuring both reviews and regular research articles. The focus is new opportunities for application of EPR and new directions for development of EPR. This introduction concisely surveys the scope of EPR and hints at future developments.

我们通过《应用磁共振》特刊庆祝 EPR 80 周年,特刊中既有综述,也有常规研究文章。重点是 EPR 应用的新机遇和 EPR 发展的新方向。本导言简明扼要地概述了 EPR 的范围,并暗示了未来的发展方向。
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引用次数: 0
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Applied Magnetic Resonance
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