High-energy Peak Research Articles

Unraveling the Orbital Physics in a Canonical Orbital System KCuF_{3}.

We explore the existence of the collective orbital excitations, orbitons, in the canonical orbital system KCuF_{3} using the Cu L_{3}-edge resonant inelastic x-ray scattering. We show that the nondispersive high-energy peaks result from the Cu^{2+} dd orbital excitations. These high-energy modes display good agreement with the abinitio quantum chemistry calculation, indicating that the dd excitations are highly localized. At the same time, the low-energy excitations present clear dispersion. They match extremely well with the two-spinon continuum following the comparison with Müller ansatz calculations. The localized dd excitations and the observation of the strongly dispersive magnetic excitations suggest that the orbiton dispersion is below the resolution detection limit. Our results can reconcile with the strong local Jahn-Teller effect in KCuF_{3}, which predominantly drives orbital ordering.

TWINS Observations of the Dynamics of Ring Currents Ion Spectra on March 17 and October 7, 2015

AbstractDirect comparisons between RBSP (Van Allen Probes or Radiation Belt Storm Probes) and TWINS (Two Wide‐angle Imaging Neutral‐atom Spectrometers) for the main phase of two storms, March 17 and October 7, 2015, showed agreement between the in situ ion measurements and the ion spectra from the deconvolved energetic neutral‐atom (ENA) measurements, except when O+ ions were significant. Spatial evolution of individual energy peaks in the ion spectra is studied using TWINS data. O+ ions are seen to result in intense peaks at 5–10 keV/amu in the TWINS ion spectra. These ion populations are confined to low L shells (L < 5) and localized in the premidnight sector. When H+ ions are significant, the low energy peaks (<25 keV/amu) are found to be less intense than the high energy peaks (>25 keV/amu), located at L > 4 and localized within the premidnight sector. During times of rapidly varying AE indices, two spatially distinct peaks, between 3–5RE and 6–8RE, are observed for the ions with energies >25 keV/amu. The outer peak appears for a few hours and fades while the inner peak is more stable. These structures are found to be consistent with particle injections observed in the RBSP data. When double peaked structures are swept off, low energy ions accumulate in the premidnight to midnight sectors whereas high energy ions are located premidnight to postmidnight sectors. Faster drift orbits of >25 keV/amu ions may cause this kind of distribution.

First principles study on electronic structure, ferromagnetism and dielectric properties of α-Fe, FeSiAl and Fe3Si

Based on the plane-wave pseudo-potential theory, the first principle calculation was used to study the electronic structure, ferromagnetism and dielectric properties of α-Fe, FeSiAl and Fe3Si alloys. Results indicate that the Fe3Si has the strongest hybridization and covalent bond. And α-Fe has the most stable system structure. The PDOS shown that the peak for the imaginary part of dielectric constant in the low-energy region is due to the electronic transitions of the hybridized 3d spin-down Fe states above and below the Fermi level, and the high-energy peak of it is formed by the transitions from the broad 3d spin-down band in the valence band to the unoccupied 3d spin-down states. Compared with α-Fe and FeSiAl, the imaginary part of the dielectric constant of Fe3Si is larger, and the magnetic moment of Fe3Si alloy is the largest according to the electronic structure and magnetic analysis. Therefore, Fe3Si has better absorbing properties.

Ultrafast charge dynamics and photoluminescence in bilayer MoS2

Our examination of the interplay of ultrafast charge dynamics and electron–phonon interaction in the AA′ stacked bilayer MoS2 provides a microscopic basis for understanding the features (two peaks) in the emission spectrum. We demonstrate that while the initial accumulation of excited charge occurs at and near the Q point of the two-dimensional Brillioun zone, emission takes place predominantly through two pathways: direct charge recombination at the K point and indirect phonon-assisted recombination of electrons at the valley and holes at the hill of the Brillouin zone. Analysis of the wave vector dependencies of the electron–phonon interaction traces the higher energy peak to phonon-assisted relaxation of the excited electrons from the Q to the K valley in the conduction band. Our results thus reveal the importance of ultrafast charge dynamics in understanding photoemissive properties of a few-layer transition-metal dichalcogenide. These calculations are based on time dependent density functional theory in the density matrix formulation.

Design optimization and optical performance analysis on multi-sectioned compound parabolic concentrator with plane absorber

The traditional standard compound parabolic concentrator (S-CPC) lacks flexibility in production and application due to its high-precision curved surface structure, and the extremely non-uniform flux distribution on the absorber greatly affects the stability of system. A novel method for performance optimization design of multi-sectioned compound parabolic concentrator (M-CPC) based on exhaustive algorithm was presented in this paper. The prototype model was established according to the outcome of program calculation, and the concentrated optical path of the designed model was studied by laser verification experiment integrating precision apparatus. The result demonstrated that the intersection position on solar cell surface obtained from calculation outcomes were consistent with the experimental consequences. Five kinds of optimized M-CPCs were designed and compared with S-CPC in optical performance. It is found that M-CPC4 is the optimal structure in this design, whose improvement ratio of average optical efficiency and acceptance angle are 1.375% and 47% respectively compared with S-CPC. Moreover, M-CPC4 could significantly reduce the higher energy peak while ameliorating the non-uniform flux distribution on absorber. This will enable the work system to maintain a relatively stable temperature gradient. The proposed design method could provide technical reference on efficient optical efficiency and structure optimization for M-CPC.

Experimental and Theoretical Investigation into the Polaron Structure of K-Doped Polyfluorene Films

The evolution of the electronic structure and optical transition upon n-doping of poly(9,9-dioctylfluorene) (PFO) films is elucidated with photoelectron spectroscopy, optical absorption, density functional theory (DFT), and time-dependent DFT (TD-DFT) calculations. Optical absorption measurements extending into near infrared show two low-energy absorption features at low doping ratios and an additional peak at a higher energy of ∼2.2 eV that disappears with increasing doping ratios. A gap state (i.e., polaronic state) close to the Fermi level and a significantly destabilized highest valence band appear in the experimentally measured ultraviolet photoelectron spectra. These experimental results are interpreted by the TD-DFT calculations, which show that the lower energy peaks originate from the excitation from polaronic states to the conduction band, while the higher energy peak mainly originates from the destabilized valence band to conduction band transitions and only appears at low doping ratios (cred ≤ 50%, 0.5 potassium atom per fluorene monomer). The DFT calculations further indicate that polaron pairs rather than bipolarons are preferentially formed at high doping ratios. Comparing the results of doped glassy and β-phase films, we find that the ordered segments in the β-phase film disappear due to the dopant (potassium) insertion, resulting in a similar polaronic structure.

Raman and FTIR Spectroscopy of Synthetic Amphiboles: I. The OH Librational Bands and the Determination of the OH-F Content of Richterites via Raman Spectroscopy

Abstract Unpolarized FTIR and Raman spectra were collected in the regions 4000–4600 cm–1 (NIR) and 100–4000 cm–1 from previously synthesized and characterized amphiboles in the systems richterite–fluoro-richterite, potassic-richterite–potassic-fluoro-richterite, rubidium-richterite–rubidium-fluoro-richterite, and potassic-richterite–deuterated potassic-richterite. The NIR spectra of Na-, K-, and Rb-richterites have peaks at 4325, 4210 cm–1, and 3735–3730 cm–1. All three peaks decrease in intensity with increasing F content, indicating that the higher-energy peaks are combination bands involving the principal OH-stretch at 3735–3730 cm–1 and two OH-libration modes, the frequencies of which can be calculated from the relation ωcombination ≈ ωOH + ωlibration; these are 590 and 475 cm–1, respectively. The FTIR spectra of the richterite–fluoro-richterite and potassic-richterite–potassic-fluoro-richterite series show decreasing intensity and eventual disappearance of the band at ∼600 cm–1 with increasing F in accord with the assignment of this band as due to OH-libration. Raman spectra of the potassic-richterite–deuterated potassic-richterite amphiboles in the low-energy region show the disappearance of two peaks at 585 and 473 cm–1 that we have assigned to OH-libration modes. Collectively, these spectroscopic results indicate that there are two OH-libration modes at ∼590 and ∼475 cm–1 in these synthetic richterites and, by implication, in all monoclinic OH-bearing amphiboles with filled A sites. Similarly to FTIR, the relative intensities of the stretching modes associated with OH-A-OH and OH-A-F local configurations in the Raman spectra provide a reliable estimation of the F content in these A site-filled amphiboles.

Distributed beamforming based wireless power transfer: Analysis and realization

This paper presents a new Wireless Power Transfer (WPT) approach by aligning the phases of a group of spatially distributed Radio Frequency (RF) transmitters (TX) at the target receiver (RX) device. Our approach can transfer energy over tens of meters and even to targets blocked by obstacles. Compared to popular beamforming based WPTs, our approach leads to a drastically different energy density distribution: the energy density at the target receiver is much higher than the energy density at other locations. Due to this unique energy distribution pattern, our approach offers a safer WPT solution, which can be potentially scaled up to ship a higher level of energy over longer distances. Specifically, we model the energy density distribution and prove that our proposed system can create a high energy peak exactly at the target receiver. Then we conduct detailed simulation studies to investigate how the actual energy distribution is impacted by various important system parameters, including number/topology of transmitters, transmitter antenna directionality, the distance between receiver and transmitters, and environmental multipath. Finally, we build an actual prototype with 17 N210 and 4 B210 Universal Software Radio Peripheral (USRP) nodes, through which we validate the salient features and performance promises of the proposed system.

The Interaction of Hydrogen with Iron Benzene-1,3,5-Tricarboxylate (Fe-BTC)

Inelastic neutron scattering (INS) spectroscopy is used to explore the 0–12,000 cm−1 range to characterise the interaction of H2 with iron benzene-1,3,5-tricarboxylate (Fe-BTC). Two peaks are observed in the low energy (<350 cm−1) region after exposure to H2. Measurements with hydrogen deuteride (HD) confirm that the peaks originate from H2. The most likely explanation is that there are two populations of H2 (HD) present. For both the H2- and the HD-loaded samples, the higher energy peak is close in energy to that of the pure isotopomer, so it is assigned to bulk-like H2/HD held in pores of the Fe-BTC. The lower energy peak is assigned to H2/HD interacting directly with the Fe ion exposed on dehydration. It was also possible to detect the H–H stretch in the same experiment; however, unfortunately, the instrumental resolution is insufficient to separate the stretch modes of the bound H2 (HD) and that in the pores.

Peak tailing cancellation techniques for digital CR-(RC)n filter

The CR-(RC)n filter is used for Semi-Gaussian pulse shaping in analog spectroscopy. A new digital CR-(RC)n filter is presented based on the recursive models of the CR filter and RC filter. The spectroscopic signal reconstruction technique is proposed. This technique is applied to digital exponential decay signals obtained by the digitization of analog signals that represent the combined response of a FAST-SDD detector and the associated front-end circuit. Compared with the direct application of the digital CR-(RC)n filter, the technique eliminates the undershoot of the Semi-Gaussian pulse which is the primary cause of the low-energy peak tailing. And, the digital pole-zero cancellation filter follows digital CR-(RC)n filter to reduce the long tail of the shaped Semi-Gaussian pulse which leads to the high-energy peak tailing. Experimental results based on XRF signals of manganese sample show that the proposed techniques can cancel peak tailing due to the shaped Semi-Gaussian pulse improving FWTM/FWHM ratio and throughput capability.

Exciton emissions of CdS nanowire array fabricated on Cd foil by the solvothermal method* *Project supported by the Natural Science Foundation of Henan Province, China (Grant No. 202300410304) and Key Research Project for Science and Technology of the Education Department of Henan Province, China (Grant No. 21A140021).

Nanowires have recently attracted more attention because of their low-dimensional structure, tunable optical and electrical properties for next-generation nanoscale optoelectronic devices. CdS nanowire array, which is (002)-orientation growth and approximately perpendicular to Cd foil substrate, has been fabricated by the solvothermal method. In the temperature-dependent photoluminescence, from short wavelength to long wavelength, four peaks can be ascribed to the emissions from the bandgap, the transition from the holes being bound to the donors or the electrons being bound to the acceptors, the transition from Cd interstitials to Cd vacancies, and the transition from S vacancies to the valence band, respectively. In the photoluminescence of 10 K, the emission originated from the bandgap appears in the form of multiple peaks. Two stronger peaks and five weaker peaks can be observed. The energy differences of the adjacent peaks are close to 38 meV, which is ascribed to the LO phonon energy of CdS. For the multiple peaks of bandgap emission, from low energy to high energy, the first, second, and third peaks are contributed to the third-order, second-order, and first-order phonon replica of the free exciton A, respectively; the fourth peak is originated from the free exciton A; the fifth peak is contributed to the first-order phonon replica of the excitons bound to neutral donors; the sixth and seventh peaks are originated from the excitons bound to neutral donors and the light polarization parallel to the c axis of hexagonal CdS, respectively.

Automatic Velocity Analysis Using a Hybrid Regression Approach With Convolutional Neural Networks

The definition of reliable velocity functions is paramount for obtaining high-quality poststack seismic data. Velocity functions are commonly created with the interpreter interactively selecting high-energy peaks in velocity spectra and verifying if the derived velocity functions match the traveltime trajectories in the corresponding common midpoint (CMP) gathers. Modern software further allows the interpreter to apply resulting moveout corrections and verify if the desired overall flatness of reflection events is achieved. This very detailed process takes a significant amount of time, not necessarily delivering the globally optimal velocity function, and ultimately impacting the cost and duration of a typical seismic interpretation procedure. In this work, we present a hybrid regression approach based on convolutional neural networks (CNN) to speed up the velocity analysis workflow. The proposed methodology consists of an automatic initial velocity function estimation followed by a supervised refinement process that requires only a handful of gathers to be manually picked. Experiments performed on five field data sets show that the proposed methodology can not only produce human-grade velocity pickings but also outperform the interpreter in some cases, in a fraction of the time taken by the human counterpart.

Quantitative Monte Carlo-based brain dopamine transporter SPECT imaging.

Brain dopamine transporter imaging with I-123-labeled radioligands is technically demanding due to the small size of the imaging target relative to the spatial resolution of most SPECT systems. In addition, I-123 has high-energy peaks which can penetrate or scatter in the collimator and be detected in the imaging energy window. The aim of this study was to implement Monte Carlo (MC)-based full collimator-detector response (CDR) compensation algorithm for I-123 into a third-party commercial SPECT reconstruction software package and to evaluate its effect on the quantitative accuracy of dopaminergic-image analysis compared to a method where only the geometric component of the CDR is compensated. In this work, we utilized a full Monte Carlo collimator-detector model and incorporated it into an iterative SPECT reconstruction algorithm. The full Monte Carlo model reconstruction was compared to standard reconstruction using an anthropomorphic striatal phantom filled with different I-123 striatal/cortex uptake ratios and with clinical I-123 Ioflupane DaTScan studies. Reconstruction with the full model yielded higher (13-25%) striatal uptake ratios than the conventional reconstruction, but the uptake ratios were still much lower than the true ratios due to partial volume effect. Visually, images reconstructed with the full Monte Carlo model had better contrast and resolution than the conventional images, with both phantom and patient studies. Reconstruction with full Monte Carlo collimator-detector model yields higher quantitative accuracy than conventional reconstruction. Additional work to reduce the partial volume effect related errors would improve the accuracy further.

Exotic nuclear shape due to cluster formation at high angular momentum

It is shown, for the first time, how the exotic shapes due to cluster formation at high excitation energy and angular momentum are manifested through giant dipole resonance (GDR) strength function under the framework of the extended quantum molecular dynamics (EQMD) model. The results of EQMD calculation are compared with the existing experimental data of $^{32}\mathrm{S}$ and $^{28}\mathrm{Si}$ formed in the reactions $^{20}\mathrm{Ne}+^{12}\mathrm{C}$ and $^{16}\mathrm{O}+^{12}\mathrm{C}$, respectively, at high angular momenta. It is found that the EQMD predicts the general trend of the experimental GDR strength functions for $^{32}\mathrm{S}$ and $^{28}\mathrm{Si}$ by considering the ring or toroidal configuration, whereas the linear chain configurations with $\ensuremath{\alpha}$ clusters can reproduce the higher-energy peak in $^{32}\mathrm{S}$ and $^{28}\mathrm{Si}$. Thus, the direct signature of the cluster formation at high temperature and angular momentum is the observation of a GDR peak $\ensuremath{\approx}25\phantom{\rule{0.28em}{0ex}}\mathrm{MeV}$ which cannot be predicted within the mean-field calculations. The present result highlights the role of $\ensuremath{\alpha}$ cluster states above the decay threshold, which is still an open field of investigation.

Radon measurements with a compact, organic-scintillator-based alpha/beta spectrometer

We have developed a compact, organic-scintillator-based alpha/beta spectrometer for radon measurements and have characterized it using a unique, small radon chamber. The spectrometer is composed of a through-silicon via (TSV) silicon photomultiplier (or SiPM) and a 6 mm × 6 mm × 6 mm stilbene crystal cube. Analog signals from the SiPM are sent to a digitizer. The detector is housed in a light-tight box, with a stacked air filter installed in one side of the box to enable 222Rn gas to diffuse to the inside. We conducted one experiment with the spectrometer and an AlphaGUARD detector placed in a basement at the University of Michigan, and we conducted other experiments with both detectors placed in a small radon chamber together with 226Ra sources. By applying a pulse-shape-discrimination technique, we were able to separate the alpha and beta spectra simultaneously and clearly and to measure them quantitatively. We found two peaks in the measured alpha spectrum: a lower-energy peak due to 218Po and a higher-energy peak due to 214Po. We found a linear relation between the radon concentration y from AlphaGUARD and the counting rates x from the stilbene-SiPM detector: y (Bq/m3) = 51 x −276. The alpha/beta spectrometer is less than 10 mm thick, and we expect that it will be easy to increase the sensitivity with future device construction. Thus, this compact, organic-scintillator-based alpha/beta spectrometer shows promise for use in novel radon-detection systems.

Photo- and electro-luminescence studies of semipolar (112¯2) InxAl1−xN

InxAl1−xN (0.15 < x < 0.4) single layers (thickness = 300 nm) and light emitting diodes (LEDs) with InxAl1−xN (x = 0.24 or 0.28) quantum wells (QWs) were grown on (112¯2) free-standing GaN substrates by metal organic chemical vapor deposition. The emission characteristics of InxAl1−xN films and QWs were then investigated by photoluminescence (PL), cathodoluminescence (CL), and electroluminescence (EL). PL emission down at 1.87 eV (∼660 nm) was observed from In0.37Al0.63N at room temperature. However, its emission wavelength and spectral width showed almost no temperature-dependence, strongly suggesting the radiative recombination process in In0.37Al0.63N is heavily affected by the potential fluctuations associated with the defect levels such as deep donor–acceptor pairs (DAPs). For In0.23Al0.77N, the emission peaks at 3.24 and 2.4 eV were observed at 300 K but CL showed no evidence of compositional fluctuations. Given the wide spectral width and weak In clustering, PL at 3.24 eV is likely from a shallow DAP transition involving an impurity-related shallow donor and valence band. PL emission at 2.4 eV, on the other hand, behaved more like In0.37Al0.63N, suggesting significant deep DAP transitions. Both LEDs with In0.24Al0.76N and In0.28Al0.72N QWs showed a discrete blueshift of the emission peak with increasing injection current, which is very different from the gradual shift observed in InGaN LEDs. The high-energy peak was much narrower than the low-energy peak, suggesting it could be the near-band edge emission. Si doping of In0.24Al0.76N QWs lowered the injection current level at which the high-energy peak appears.

Growth and Structural Characterization of Doped Polymorphic Crystalline MgPc as an Organic Semiconductor

The doping and crystallization of the molecular semiconductor formed from the magnesium phthalocyanine (MgPc) and 1-(4-Methoxyphenyl)-2,2,6,6-tetramethyl-5-phenylhepta-3,4-dienedioic (MTPDA) acid was carried out in this work. The crystals obtained were characterized by using transmission electronic microscopy (TEM), Raman spectroscopy, and X-Ray diffraction (XRD), to later evaluate their optical behavior. Raman, IR, and UV–Vis results indicate that the MgPc has been doped with the MTPDA. A uniform material layer with particles is observed as a result of a two-stage process, nucleation and growth. The polycrystalline films are constituted by a mixture of α and β phases with crystalline sizes of ~7 nm, 14 nm, and 20 nm average sizes. The films exhibit a preferred orientation along the [001]. The MTPDA doping does not have an important effect on the molecule planar distances indicating that the MTPDA molecule is among the equivalent MgPc plane direction. A transparent region with a minimum at 483 nm is observed, also a B-band at 337 nm and a Q-band transition with a high-energy peak around 639 nm, and a low energy peak around 691 nm.

Ion energy distributions at substrate in bipolar HiPIMS: effect of positive pulse delay, length and amplitude

A bipolar HiPIMS discharge with a rectangular positive voltage pulse (with controllable amplitude, delay after the main negative pulse and positive pulse length) was systematically investigated by mass spectroscopy. The time-averaged spectra of ions measured at the substrate position exhibit a prominent high-energy peak. It is shown that the position of the peak can be varied by the positive pulse amplitude, its magnitude scales with the pulse length and its width can be slightly influenced by the length of the delay interval. Measurements of the plasma potential at the mass spectrometer position and time-resolved mass spectroscopy clearly show that the high-energy peak is formed by ions accelerated by the elevated plasma potential during the positive pulse. In addition, fine details of the ion energy distribution functions related to the plasma potential transients at the start of the positive pulse are identified. The presented results are beneficial for the optimisation of the parameters of the positive pulse in experiments implementing the bipolar HiPIMS technology.

Temperature Dependence of the Stark Shifts of Er3+ Transitions in Er2O3 Thin Films on Si(001)

Optical transitions of an Er$_2$O$_3$ film on a Si substrate grown by using a metal-organic chemical vapor deposition technique were investigated in a wide temperature (300 K $\sim$ 5 K) and spectral (500 nm and 850 nm) ranges. Numerous sharp transitions corresponding to the Er$^{3+}$ ionic levels were observed, which show Stark shifts induced by the crystal field. With decreasing temperature from 300 K to 5 K, all transition peaks exhibit spectral red-shift. We believe that such red-shift behavior is due to the change of the crystal field together with the change of strain field induced by the film and the substrate in varying temperature. An interesting result is the total amount of red-shifts between 300 K and 5 K. We obtain that the higher transition energy peaks show bigger red-shifts. This is very consistent to all transition peaks. This is because the dipole moments between the transition levels are different that lead to different amounts of Stark shifts.

Turbulent Model of Crab Nebula Radiation

Abstract We construct a turbulent model of the Crab Nebula’s nonthermal emission. The present model resolves a number of long-standing problems of the Kennel–Coroniti model: (i) the sigma problem, (ii) the hard spectrum of radio electrons, (iii) the high peak energy of gamma-ray flares, (iv) and the spatial evolution of the infrared (IR) emission. The Nebula contains two populations of injected particles: Component-I, accelerated at the wind termination shock via the Fermi-I mechanism; and Component-II, accelerated in reconnecting turbulence in highly magnetized (σ ≫ 1) plasma in the central part of the Crab Nebula. The reconnecting turbulence in Component-II extends from radio to gamma-rays: it accelerates radio electrons with a hard spectrum, destroys the large-scale magnetic flux (and thus resolves the sigma problem), and occasionally produces gamma-ray flares (from the largest-scale reconnection events). The model reproduces the broadband spectrum of the Crab Nebula, from low-frequency synchrotron emission in radio to inverse-Compton emission at TeV energies, as well as the spatially resolved evolution of the spectral indices in the IR and optical bands.